Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8724069 | 0.90 | CYP11B1 (0.33) | CYP11B1CYP11B2CYP3A4CYP2C9POLB | |
| SCHEMBL8721411 | 0.76 | TSHR (0.51) | CYP11B1CYP11B2CYP3A4CYP2C9POLB | |
| SCHEMBL8721420 | 0.74 | CYP17A1 (0.40) | CYP11B1CYP11B2CYP3A4CYP2A6CYP2C9 | |
| SCHEMBL8724347 | 0.74 | CYP3A4 (0.45) | CYP11B1CYP11B2CYP3A4CYP2A6CYP2C9 | |
| SCHEMBL8726118 | 0.72 | CYP3A4 (0.45) | CYP11B1CYP11B2CYP3A4CYP2A6CYP2C9 | |
| SCHEMBL667254 | 0.72 | KDM4E (0.43) | CYP3A4CYP2A6CYP2C9CYP2E1CYP2B6 | |
| SCHEMBL27457703 | 0.70 | MEN1 (0.60) | CYP11B1CYP11B2CYP3A4CYP2A6CYP2C9 | |
| SCHEMBL8724071 | 0.69 | KDM4E (0.37) | MEN1KMT2AKDM4EGAAALDH1A1 | |
| SCHEMBL8724216 | 0.69 | CYP11B1 (0.42) | CYP11B1CYP11B2CYP3A4CYP2A6CYP2C9 | |
| SCHEMBL8722338 | 0.69 | KDM4E (0.30) | CYP3A4KDM4EALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998000430-A1 | IMIDAZOL DERIVATIVES USEFUL AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-01-08 | — | — | WO | disclosed |