Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | CD44 | P16070 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8962591 | 0.97 | HSD17B10 (0.43) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 | |
| Maleic Acid SCHEMBL7322062 | 0.92 | MCL1 (0.39) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 | |
| Fumaric Acid SCHEMBL7322067 | 0.92 | MCL1 (0.39) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 | |
| SCHEMBL7304185 | 0.83 | CYP1A2 (0.32) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL7302142 | 0.83 | CASP6 (0.40) | CYP1A2CYP3A4ADRA2CHTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL7298417 | 0.81 | CASP6 (0.39) | CYP1A2CYP3A4ADRA2CHTR2AHTR2C | |
| SCHEMBL9587051 | 0.80 | CYP1A2 (0.61) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 | |
| SCHEMBL9585427 | 0.79 | CYP1A2 (0.55) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 | |
| SCHEMBL9366393 | 0.79 | CYP3A4 (0.43) | CYP1A2CYP3A4ADRA2CHTR2AHTR2C | |
| SCHEMBL9090622 | 0.77 | CYP1A2 (0.62) | HSD17B10HPGDUSP2ALDH1A1CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0375045-A1 | New annelated indole derivatives | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1990-06-27 | — | — | EP | disclosed |