Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ATR | Q13535 | 3/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | BCR | P11274 | 1/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11222723 | 0.74 | CNR1 (0.64) | ALDH1A1HPGDCYP11B1CYP11B2HSD17B10 | |
| SCHEMBL29611891 | 0.73 | NPC1 (0.65) | ALDH1A1HPGDHSD17B10NPC1RAB9A | |
| SCHEMBL11192637 | 0.73 | NPC1 (0.65) | ALDH1A1HPGDHSD17B10NPC1RAB9A | |
| SCHEMBL6985231 | 0.72 | NPC1 (0.55) | ALDH1A1HPGDCYP11B1CYP11B2HSD17B10 | |
| SCHEMBL29602550 | 0.68 | RAB9A (0.65) | ALDH1A1CYP11B2HSD17B10NPC1RAB9A | |
| SCHEMBL49506 | 0.68 | RAB9A (0.65) | ALDH1A1CYP11B2HSD17B10NPC1RAB9A | |
| SCHEMBL24892502 | 0.67 | AAK1 (0.49) | ALDH1A1HPGDCYP11B1CYP11B2HSD17B10 | |
| SCHEMBL19706697 | 0.67 | ALDH1A1 (0.53) | ALDH1A1HPGDCYP11B1CYP11B2HSD17B10 | |
| SCHEMBL1570408 | 0.67 | HPGD (0.53) | ALDH1A1HPGDCYP11B1CYP11B2HSD17B10 | |
| SCHEMBL6983318 | 0.67 | NPC1 (0.51) | ALDH1A1HPGDCYP11B1CYP11B2HSD17B10 |
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-1071668-B1 | 5-AMINOINDENO[1,2-C]PYRAZOL-4-ONES AS ANTI-CANCER AND ANTI-PROLIFERATIVE AGENTS | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2009-06-03 | — | — | EP | disclosed |