Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20196091 | 0.81 | CYP1A2 (0.38) | CYP1A2CYP2C9MAPK1RAB9AALDH1A1 | |
| SCHEMBL20196059 | 0.75 | GRIN2D (0.38) | CYP1A2CYP2C9MAPK1RAB9AALDH1A1 | |
| SCHEMBL16676160 | 0.69 | SMN1; SMN2 (0.33) | MAPK1RAB9AALDH1A1NPC1HPGD | |
| SCHEMBL5073560 | 0.69 | ALDH1A1 (0.52) | CYP1A2CYP2C9MAPK1ALDH1A1CYP3A4 | |
| SCHEMBL3525581 | 0.67 | ALDH1A1 (0.38) | CYP1A2CYP2C9MAPK1ALDH1A1CYP3A4 | |
| SCHEMBL1648006 | 0.66 | ALDH1A1 (0.36) | CYP1A2CYP2C9MAPK1RAB9AALDH1A1 | |
| SCHEMBL16248130 | 0.66 | GRIN2D (0.36) | CYP1A2MAPK1RAB9AALDH1A1CYP2C19 | |
| SCHEMBL1505192 | 0.66 | ALDH1A1 (0.36) | CYP1A2CYP2C9MAPK1ALDH1A1CYP3A4 | |
| SCHEMBL9993152 | 0.66 | HSD17B10 (0.56) | CYP1A2CYP2C9MAPK1ALDH1A1CYP3A4 | |
| SCHEMBL15357971 | 0.66 | DDR1 (0.36) | CYP1A2CYP2C9CYP3A4CYP2C19LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2842939-B1 | BENZAMIDE DERIVATIVE | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2018-05-30 | — | — | EP | disclosed |