Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11187040 | 0.88 | MAOA (0.43) | CYP1A2CYP2D6MAOAMAOBNISCH | |
| SCHEMBL11186437 | 0.86 | MEN1 (0.37) | CYP1A2CYP2D6KDM4ENPC1RAB9A | |
| SCHEMBL11180683 | 0.81 | ADRA2B (0.46) | CYP1A2CYP2D6KDM4E | |
| SCHEMBL11187150 | 0.79 | CYP2D6 (0.37) | CYP1A2CYP2D6DRD4CRHBPCRHR2 | |
| SCHEMBL11187929 | 0.79 | CYP2D6 (0.37) | CYP1A2CYP2D6NISCHDRD4KDM4E | |
| Hydrochloric Acid SCHEMBL11191332 | 0.78 | CYP2D6 (0.36) | CYP1A2CYP2D6DRD4CRHBPCRHR2 | |
| SCHEMBL11190221 | 0.77 | CYP1A2 (0.74) | CYP1A2CYP2D6DRD4TAAR1 | |
| SCHEMBL11189667 | 0.72 | MAOA (0.40) | MAOAMAOBNISCHTAAR1KDM4E | |
| SCHEMBL11182289 | 0.72 | KDM4E (0.56) | CYP1A2KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4221042 | 0.72 | MAOA (0.42) | CYP1A2CYP2D6MAOAMAOBNISCH |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4420619-A | Imidazole urea and amido compounds | CIBA-GEIGY CORPORATION (US) | 1983-12-13 | — | — | US | disclosed |
| EP-0004561-B1 | UREA AND AMIDE DERIVATIVES, THEIR PREPARATION, PHARMACEUTICALS CONTAINING THEM AND THEIR USE FOR PREPARING PHARMACEUTICAL COMPOSITIONS | CIBA-GEIGY AG (CH) | 1981-11-04 | — | — | EP | disclosed |
| US-4292429-A | Imidazole urea and amido compounds | CIBA-GEIGY CORPORATION (US) | 1981-09-29 | — | — | US | disclosed |
| EP-0004561-A2 | Urea and amide derivatives, their preparation, pharmaceuticals containing them and their use for preparing pharmaceutical compositions | CIBA-GEIGY AG (CH) | 1979-10-17 | — | — | EP | disclosed |