Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555134 | 0.82 | ALDH1A1 (0.37) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8557627 | 0.76 | PDK2 (0.46) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8560283 | 0.73 | KDM4E (0.37) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8556692 | 0.71 | KDM4E (0.36) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8555625 | 0.70 | CYP3A4 (0.43) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8557800 | 0.70 | KDM4E (0.35) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8557767 | 0.69 | THRA (0.36) | ALDH1A1HPGDKDM4EMAPTPDE4B | |
| SCHEMBL20088307 | 0.69 | ALDH1A1 (0.40) | ALDH1A1HPGDKDM4EMAPTCA12 | |
| SCHEMBL8556238 | 0.68 | PDK2 (0.34) | ALDH1A1HPGDKDM4EMAPTPDK2 | |
| SCHEMBL8554583 | 0.67 | PDE4B (0.37) | ALDH1A1HPGDKDM4EPDE4BPTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0653426-B1 | Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same | KOWA CO (JP) | 1998-07-22 | — | — | EP | disclosed |
| US-5510366-A | INOTROPIC, ANTIARRHYMTHMIA AGENTS, VASODILATORS | KOWA CO., LTD. (JP) | 1996-04-23 | — | — | US | disclosed |
| EP-0653426-A1 | Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same | KOWA COMPANY, LTD. (JP) | 1995-05-17 | — | — | EP | disclosed |