Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ECE1 | P42892 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9213965 | 1.00 | CYP2C9 (0.42) | CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9218004 | 0.99 | CYP2C9 (0.41) | CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9217997 | 0.99 | CYP2C9 (0.41) | CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9212201 | 0.84 | S1PR3 (0.47) | CYP2C9CYP2C19CYP3A4EPHX2KMT2A | |
| SCHEMBL9212178 | 0.84 | S1PR3 (0.47) | CYP2C9CYP2C19CYP3A4EPHX2KMT2A | |
| Hydrochloric Acid SCHEMBL9211777 | 0.83 | S1PR3 (0.46) | CYP2C9CYP2C19CYP3A4EPHX2KMT2A | |
| Hydrochloric Acid SCHEMBL9211779 | 0.83 | S1PR3 (0.46) | CYP2C9CYP2C19CYP3A4EPHX2KMT2A | |
| SCHEMBL9211713 | 0.78 | EPHX2 (0.46) | CYP2C9CYP2C19CYP3A4EPHX2KMT2A | |
| SCHEMBL9211715 | 0.78 | EPHX2 (0.46) | CYP2C9CYP2C19CYP3A4EPHX2KMT2A | |
| SCHEMBL9211586 | 0.78 | NAMPT (0.49) | CYP2C19CYP3A4ECE1EPHX2KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0388528-B1 | Carboximidamide derivatives | KIRIN BREWERY (JP) | 1995-09-27 | — | — | EP | claimed |
| EP-0388528-A2 | Carboximidamide derivatives | KIRIN BEER KABUSHIKI KAISHA (JP) | 1990-09-26 | — | — | EP | claimed |
| EP-0388528-B1 | Carboximidamide derivatives | KIRIN BREWERY (JP) | 1995-09-27 | — | — | EP | disclosed |
| US-5223508-A | Hypotensive agents, vasodilators | KIRIN BEER KABUSHIKI KAISHA (JP) | 1993-06-29 | — | — | US | disclosed |
| US-5166347-A | Hypotensive agents, cardiovascular disorders, antiischemic agents and anticoagulants | KIRIN BEER KABUSHIKI KAISHA (JP) | 1992-11-24 | — | — | US | disclosed |