IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: Cc1c(O)c(O)c(O)c(CO)c1CO

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol is a natural product found in Aspergillus terreus with data available.
Molecule SMILES: NC(=O)N1c2ccccc2C2OC2c2ccccc21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: Carbamazepine-10,11-epoxide is an epoxide and metabolite of carbamazepine. It has a role as a marine xenobiotic metabolite, a drug metabolite and an allergen. It is an epoxide, a member of ureas and a dibenzoazepine. It is functionally related to a carbamazepine.
Molecule SMILES: COc1cc(C2Oc3c(OC)cc(C(=O)O)cc3C2CO)ccc1OC1OC(CO)C(O)C(O)C1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: (2R,3S)-3-(hydroxymethyl)-7-methoxy-2-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydro-1-benzofuran-5-carboxylic acid is a natural product found in Urena lobata with data available.
Molecule SMILES: CC1CN(C(C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2COC1CN(C)Cc1cccnc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: LSM-12354 is an indolyl carboxylic acid.
Molecule SMILES: CC1(Cl)CC(O)C2(CC1Br)C(C)(C)C(Br)CC1OC12C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: (1S,1'R,2R,4S,4'S,5'S,6R)-4,4'-dibromo-5'-chloro-1,3,3,5'-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,2'-cyclohexane]-1'-ol is a natural product found in Laurencia dendroidea and Palisada flagellifera with data available.
Molecule SMILES: CC(=O)NC1C(O)OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(OC3OC(COC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C(O)C(O)C3O)C(O)C2NC(C)=O)C1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: N-[(3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-Acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-2,4-dihydroxy-6-[[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]acetamide is an amino sugar.
Molecule SMILES: COc1ccc2c(=O)c3c(OC)c(O)cc(O)c3oc2c1OC

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: 2,4-Dihydroxy-1,5,6-trimethoxyxanthen-9-one is a natural product found in Tripterospermum chinense with data available.
Molecule SMILES: C=C(CO)C12C=C3C(=O)CC(C(C)C)C3(C)CC(OC(C)=O)C1(C)CC(=O)O2

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: 6-O-acety-trichaurantin is a natural product found in Tricholoma aurantium with data available.
Molecule SMILES: CCCCCCCCCCCCOCCOCCOCCOCCOCCO

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: Laureth-5 is a hydroxypolyether that is pentaethylene glycol in which one of the terminal hydrogens is replaced by a dodecyl group. It has a role as a nonionic surfactant. It is a hydroxypolyether, a pentaethylene glycol and a primary alcohol.
Molecule SMILES: CCCCCCCCCCCCOCCOCCOCCOCCOCCO

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Pentaethylene glycol monododecyl ether is a natural product found in Solanum lycopersicum with data available.
Molecule SMILES: Cc1cc(C)cc(NC(=O)C(Nc2ccccc2)c2ccccc2)c1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: 2-anilino-N-(3,5-dimethylphenyl)-2-phenylacetamide is an amino acid amide.
Molecule SMILES: CC(=O)OC(c1nc2ccccc2c(=O)n1C1CC2(OC1=O)C(=O)Nc1ccccc12)C(C)C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Aspertoryadin G is a natural product found in Aspergillus with data available.
Molecule SMILES: NC1CCC(CCn2cc(-c3cccc(F)c3)nn2)OC1CO

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: [(2S,3S,6R)-3-amino-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-oxanyl]methanol is a C-glycosyl compound.
Molecule SMILES: COc1cc(C=Cc2cccc(=O)o2)ccc1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: 6-[2-(4-Hydroxy-3-methoxyphenyl)ethenyl]pyran-2-one is a natural product found in Aniba parviflora with data available.
Molecule SMILES: CC(=O)CC1(O)C(=O)C=C2C(=O)OC3C(OC(=O)c4cc(O)c(O)c(O)c4)OC4COC(=O)c5cc(O)c(O)c(O)c5-c5c(cc(O)c(O)c5O)C(=O)OC3C4OC(=O)c3cc(O)c(O)c4c3C2C1(O)O4

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: Ellagitannin is a class of polyphenols that are formed by the oxidative linkage of galloyl groups to the pentahydroxy gallic acid ester of glucose where the galloyl groups are linked through C-C bonds. Ellagitannins have diverse effects including anti-oxidant, anti-proliferative, anti-viral, and anti-microbial activities.
Molecule SMILES: C#CB(OC)OC

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Dimethyl ethynylboronate is an alkynylboronic ester and a terminal acetylenic compound.
Molecule SMILES: COc1ccc(C(=O)[O-])c(NC(=O)c2ccccc2)c1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: N-benzoyl-4-methoxyanthranilate is a methoxybenzoate that it is obtained by removal of a proton from the carboxylic acid group of N-benzoyl-4-methoxyanthranilate. It is a methoxybenzoate and an amidobenzoate. It is functionally related to an anthranilate. It is a conjugate base of a N-benzoyl-4-methoxyanthranilic acid.
Molecule SMILES: CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(=O)c4ccccc4)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(=O)c1cccnc1)C2OC(C)=O)C4(C)O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: [19,21,22-Triacetyloxy-20-(acetyloxymethyl)-24-benzoyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-18-yl] pyridine-3-carboxylate is a natural product found in Tripterygium hypoglaucum and Tripterygium wilfordii with data available.
Molecule SMILES: N=C(N)N1Cc2ccccc2C(O)C1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: 4-hydroxydebrisoquin is an isoquinoline that is 3,4-dihydroisoquinoline bearing amidino and hydroxy substituent at positions 2 and 4 respectively. It has a role as a metabolite. It is a carboxamidine, a member of isoquinolines and a secondary alcohol.
Molecule SMILES: N=C(N)N1Cc2ccccc2C(O)C1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: 4-Hydroxydebrisoquine is a natural product found in Homo sapiens and Bos taurus with data available.
Molecule SMILES: CC1(C)CCCC2(C)CC=C(C(=O)O)C3CC312

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Hinokiic acid is a natural product found in Juniperus osteosperma, Juniperus californica, and other organisms with data available.
Molecule SMILES: COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2OC(C(=O)O)C(O)C(O)C2O)ccc1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Isorhamnetin 3-glucuronide is a glucosiduronic acid and a member of flavonoids.
Molecule SMILES: COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2OC(C(=O)O)C(O)C(O)C2O)ccc1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: Isorhamnetin 3-glucuronide is a natural product found in Rubus idaeus, Fragaria, and other organisms with data available.
Molecule SMILES: COC12CC3C=CC(=O)C(C)C3(C)CC1=C(C)C(=O)N2

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Eremophilenone lactam is a natural product found in Senecio flavus with data available.
Molecule SMILES: C=C1CCCN(CCl)CCC1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: Oxypterine is a natural product found in Lotononis oxyptera and Lotononis rostrata with data available.
Molecule SMILES: CCCNC(=O)Nc1ccc2c(c1)C(=O)N(C)CC(OC)C(C)CN(C)C(C)CO2

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: 1-[(4S,7R,8S)-8-methoxy-4,5,7,10-tetramethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propylurea is an azamacrocycle and a lactam.
Molecule SMILES: CNCC1OCCCCC(C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C(C)CO)CC1C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: 1-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(4-methoxyphenyl)urea is an azamacrocycle and a lactam.
Molecule SMILES: COc1c(O)cc(C(C(=O)O)c2cc(O)c(O)c(Br)c2Br)cc1Br

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: (2S)-2-(3-bromo-5-hydroxy-4-methoxyphenyl)-2-(2,3-dibromo-4,5-dihydroxyphenyl)acetic acid is a natural product found in Rhodomela confervoides with data available.
Molecule SMILES: C=C1CC(C)C(=O)NC(C)C(=O)N(C)C(Cc2ccc(O)c(Cl)c2)C(=O)NC(C)C(=O)OC(C)CC(C)C1=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: cyclo[D-Ala-D-N(Me)Tyr(3-Cl)-Ala-Unk] is a natural product found in Cymbastela with data available.
Molecule SMILES: COc1cc(CCc2ccccc2)oc(=O)c1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: Dihydro-5,6-dehydrokawain is an aromatic ether and a member of 2-pyranones.
Molecule SMILES: COc1cc(CCc2ccccc2)oc(=O)c1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: 2H-Pyran-2-one, 4-methoxy-6-(2-phenylethyl)- is a natural product found in Alpinia formosana, Etlingera elatior, and other organisms with data available.
Molecule SMILES: CC1CN(C(C)CO)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC1CN(C)Cc1ccc(Oc2ccccc2)cc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide is an aromatic ether.
Molecule SMILES: C=C1C2CC(OC(C)=O)C3C45CCCC(C)(C)C4C(O)C(O)(OC5OC)C3(C1O)C2O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: (7,9,10,18-Tetrahydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl) acetate is a natural product found in Isodon adenolomus with data available.
Molecule SMILES: Oc1ccc(CC2CC=CC23CCC(O)CC3)cc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: Sequosempervirin A is a natural product found in Sequoia sempervirens with data available.
Molecule SMILES: CC1CC(=O)C23COC(O)C2CC(=O)CC3C12CC(c1ccoc1)OC2=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: (3R,3aR,5'S,6aS,7R,8R,10aS)-5'-(furan-3-yl)-3-hydroxy-8-methylspiro[1,3,3a,4,6,6a,8,9-octahydrobenzo[d][2]benzofuran-7,3'-oxolane]-2',5,10-trione is a natural product found in Teucrium salviastrum with data available.
Molecule SMILES: Clc1ccccc1-c1cc(Cl)c(Cl)c(Cl)c1Cl

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: 2,2',3,4,5-Pentachlorobiphenyl is one of 209 polychlorinated biphenyls (PCBs). PCBs are a group of synthetic organic compounds with 1-10 chlorine atoms attached to biphenyl. They were manufactured as commercial mixtures but banned in the 1970's because they were found to bioaccumulate and cause harmful health effects. However, PCBs do not break down readily and are still found in the environment. (L4)
Molecule SMILES: C=C1CC(O)C2C(C)(C)C(=O)CCC2(C)C1CC(=O)c1ccoc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: Kellermanoldione is a natural product found in Brickellia oliganthes with data available.
Molecule SMILES: COC(=O)c1csc(C2CCCN2C(=O)C2CCCN2C(=O)C(NC(=O)C(N)Cc2ccc(O)cc2)C(C)C)n1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: Aeruginozamide AEG571 is a natural product found in Limnoraphis with data available.
Molecule SMILES: O=C(CN1C2=NCCN2c2ccccc21)c1ccc(-c2ccccc2)cc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: 2-(1,2-dihydroimidazo[1,2-a]benzimidazol-4-yl)-1-(4-phenylphenyl)ethanone is an aromatic ketone.
Molecule SMILES: CC(CCCCCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)OC1OC(C)C(O)CC1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: Bkas#34-CoA is coA ester of bkas#34
Molecule SMILES: CCCCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCC=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: 13-Oxodotriacontanal is a natural product found in Osmunda regalis with data available.
Molecule SMILES: CC=C1NC(=O)C(NC(=O)C(CCc2ccc(O)cc2)NC(=O)C(C)NC(=O)C(O)CO)C(C)OC(=O)C(C(C)C)NC(=O)C(Cc2ccc(O)cc2)N(C)C(=O)C(Cc2ccccc2)N2C(=O)C(CCC2O)NC1=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: Lyngbyastatin 5 is a natural product found in Lyngbya with data available.
Molecule SMILES: COC1=C2CC(C)CC(OC)C(O)C(C)C=C(C)C(OC(N)=O)C(OC)C=CC=C(C)C(=O)NC(C2=O)C1(O)SCC(NC(C)=O)C(=O)NC1C(OC2C(O)C(O)C(O)C(O)C2O)OC(CO)C(O)C1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Mccrearamycin A is a natural product found in Streptomyces with data available.
Molecule SMILES: Cc1cc2c3ccccc3ccc2c2ccccc12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: 6-Methylchrysene is a carbopolycyclic compound.
Molecule SMILES: C=C1C(=O)OC2C1C(OC(C)=O)CC1(C)C(=O)CCC(=COC(C)=O)C21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: [(E)-[(3aR,4S,5aR,9aS,9bR)-4-acetyloxy-5a-methyl-3-methylidene-2,6-dioxo-4,5,7,8,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-9-ylidene]methyl] acetate is a natural product found in Cyanthillium cinereum and Vernonanthura divaricata with data available.
Molecule SMILES: COc1cc(CCc2cccc(O)c2)c(O)c(OC)c1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: Bulbophyllidin is a natural product found in Bulbophyllum protractum with data available.
Molecule SMILES: CCN1C(=O)N(c2c(F)c(OC)cc(OC)c2F)Cc2cnc3[nH]c(CN4CCOCC4)cc3c21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Pemigatinib is a small molecule kinase inhibitor with antitumour activity. It works by inhibiting fibroblast growth factor receptors (FGFRs), which are receptor tyrosine kinases that activate signalling pathways in tumour cells. FGFRs gained attention as potential therapeutic targets in selected cancers, as FGFR gene alterations were observed in a wide variety of cancers including those of the urinary bladder, breast, ovary, prostate, endometrium, lung, and stomach. Deregulated FGFR signalling pathway can lead the development of oncogenes and tumour-promoting physiological processes, such as cancer cell proliferation, enhanced angiogenesis, and evasion of cell death.  In April 2020, pemigatinib was approved by the FDA for the treatment of unresectable locally advanced or metastatic cholangiocarcinoma in previously treated adult patients with a fibroblast growth factor receptor 2 (FGFR2) gene fusion or other rearrangements as detected by an FDA-approved test. Cholangiocarcinoma is the most common primary malignancy affecting the biliary tract and the second most common primary hepatic malignancy. This malignancy accounts for 15% to 20% of primary hepatobiliary malignancies, which account for 13% of overall cancer-related global mortality. With increasing research on the pathogenesis of cholangiocarcinoma and potential therapeutic targets for anticancer drug treatment, recent studies show that up to 45% of patients with intrahepatic cholangiocarcinoma exhibited gene rearrangements resulting in oncogenic fibroblast growth factor 2 (FGFR2) fusion proteins. The FDA-approved indication for pemigatinib was granted under accelerated approval based on the overall response rate and duration of response in pre-marketing clinical trials. Pemigatinib is marketed under the brand name Pemazyre, and it is available as oral tablets.
Molecule SMILES: CCN1C(=O)N(c2c(F)c(OC)cc(OC)c2F)Cc2cnc3[nH]c(CN4CCOCC4)cc3c21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Pemigatinib is a Kinase Inhibitor. The mechanism of action of pemigatinib is as a Kinase Inhibitor, and P-Glycoprotein Inhibitor, and Organic Cation Transporter 2 Inhibitor, and Multidrug and Toxin Extrusion Transporter 1 Inhibitor.
Molecule SMILES: CCN1C(=O)N(c2c(F)c(OC)cc(OC)c2F)Cc2cnc3[nH]c(CN4CCOCC4)cc3c21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: Pemigatinib is an orally bioavailable inhibitor of the fibroblast growth factor receptor (FGFR) types 1, 2, and 3 (FGFR1/2/3), with potential antineoplastic activity. Pemigatinib binds to and inhibits FGFR1/2/3, which may result in the inhibition of FGFR1/2/3-related signal transduction pathways. This inhibits proliferation in FGFR1/2/3-overexpressing tumor cells. FGFR, a family of receptor tyrosine kinases upregulated in many tumor cell types, plays a key role in cellular proliferation, migration, and survival.
Molecule SMILES: CCN1C(=O)N(c2c(F)c(OC)cc(OC)c2F)Cc2cnc3[nH]c(CN4CCOCC4)cc3c21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Pemigatinib is a fibroblast growth factor (FGF) receptor kinase inhibitor that is used to treat unresectable, locally advanced or metastatic intrahepatic cholangiocarcinoma, as well as myeloid or lymphoid neoplasms with FGFR rearrangements. Pemigatinib is associated with transient and usually mild-to-moderate elevations in serum aminotransferase levels during therapy, but has not been convincingly linked to cases of clinically apparent liver injury with jaundice.
Molecule SMILES: COC(=O)C(Cc1ccc(OC)cc1)NC(=O)C=Cc1ccc(OC)cc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: methyl (2S)-3-(4-methoxyphenyl)-2-[[(Z)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoate is a natural product found in Dalbergia melanoxylon with data available.