Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.52 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL25364811 | 0.86 | ALDH1A1 (0.57) | MAOBMRGPRX4ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL29524175 | 0.86 | ALDH1A1 (0.57) | MAOBMRGPRX4ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30412034 | 0.84 | MAOB (0.73) | MAOBMRGPRX4NR4A2SMPD1CYSLTR1 | |
| SCHEMBL976424 | 0.84 | MAOB (0.73) | MAOBMRGPRX4NR4A2SMPD1CYSLTR1 | |
| SCHEMBL24627608 | 0.83 | L3MBTL1 (0.65) | MAOBMRGPRX4ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3538378 | 0.82 | L3MBTL1 (0.61) | MAOBMRGPRX4ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL1122805 | 0.82 | MRGPRX4 (0.71) | MAOBMRGPRX4NR4A2SMPD1CYSLTR1 | |
| SCHEMBL320846 | 0.82 | ALDH1A1 (0.59) | MRGPRX4ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11401546 | 0.81 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1122722 | 0.81 | MAOB (0.68) | MAOBMRGPRX4NR4A2SMPD1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2590942-A1 | RHO KINASE INHIBITORS | Boehringer Ingelheim International GmbH (DE) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012006202-A1 | RHO KINASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |