Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | DAO | P14920 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8556238 | 0.76 | PDK2 (0.34) | ALDH1A1HTTCNR1GPR35GPR55 | |
| SCHEMBL8556960 | 0.75 | PDK2 (0.44) | CNR1PDK2PDK4PDK1PDK3 | |
| SCHEMBL9095539 | 0.74 | ALDH1A1 (0.36) | ALDH1A1HTTCNR1GPR35GPR55 | |
| SCHEMBL8557438 | 0.73 | PDK2 (0.42) | HTTPDK2KMT2AMEN1MAPT | |
| SCHEMBL8559099 | 0.72 | TYR (0.44) | HTTPDK2KMT2AMEN1MAPT | |
| SCHEMBL9094130 | 0.70 | ALDH1A1 (0.36) | ALDH1A1HTTCNR1GPR35GPR55 | |
| SCHEMBL8559248 | 0.70 | ALDH1A1 (0.42) | ALDH1A1HTTCNR1GPR35GPR55 | |
| SCHEMBL2264510 | 0.69 | PDK2 (0.62) | HTTCNR1GPR35GPR55PDK2 | |
| SCHEMBL3150359 | 0.69 | PDK2 (0.52) | ALDH1A1PDK2PDK4PDK1PDK3 | |
| SCHEMBL8554583 | 0.69 | PDE4B (0.37) | ALDH1A1MMP2MMP9 |
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 |