Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP1 | P24666 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 10/20 | 0.42 |
| ▸ | CASP1 | P29466 | 9/20 | 0.42 |
| ▸ | CASP7 | P55210 | 9/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CCR4 | P51679 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 5/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9738952 | 0.86 | PDE4A (0.47) | ALDH1A1CYP1A2HSD17B10CASP1CASP7 | |
| SCHEMBL9739273 | 0.83 | ACP1 (0.49) | ACP1ALDH1A1CYP1A2HSD17B10CYP2C9 | |
| SCHEMBL9741179 | 0.80 | CCR4 (0.48) | ACP1CCR4CNR2BRD4NPC1 | |
| SCHEMBL9739561 | 0.79 | PDE4A (0.52) | ACP1LMNACNR2 | |
| SCHEMBL9738722 | 0.78 | ADORA2A (0.48) | ACP1CNR2 | |
| SCHEMBL9739221 | 0.77 | ALDH1A1 (0.46) | ALDH1A1CYP1A2HSD17B10CASP1CASP7 | |
| SCHEMBL9738081 | 0.76 | YTHDC1 (0.59) | — | |
| SCHEMBL23228189 | 0.75 | CYP1A2 (0.50) | ALDH1A1CYP1A2HSD17B10CASP1CASP7 | |
| SCHEMBL23867154 | 0.74 | CYP1A2 (0.49) | ALDH1A1CYP1A2HSD17B10CASP1CASP7 | |
| SCHEMBL9738569 | 0.72 | PDE4A (0.53) | ACP1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5110818-A | Antiepileptic agents | CIBA-GEIGY CORPORATION (US) | 1992-05-05 | — | — | US | disclosed |
| EP-0363320-A2 | Substituted 9H purine | CIBA-GEIGY AG (CH) | 1990-04-11 | — | — | EP | disclosed |