Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MGLL | Q99685 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25314236 | 0.92 | TDP1 (0.57) | TDP1L3MBTL1MGLLKDM4EKMT2A | |
| SCHEMBL9799085 | 0.88 | TDP1 (0.52) | TDP1L3MBTL1MGLLKDM4ETAS1R3 | |
| SCHEMBL12493216 | 0.88 | ALDH1A1 (0.54) | TDP1L3MBTL1MGLLKDM4ETAS1R3 | |
| SCHEMBL2934574 | 0.88 | TDP1 (0.52) | TDP1L3MBTL1MGLLKMT2AALDH1A1 | |
| SCHEMBL14926458 | 0.87 | MGLL (0.64) | TDP1L3MBTL1MGLLHPGDALDH1A1 | |
| SCHEMBL17991554 | 0.86 | MGLL (0.56) | TDP1L3MBTL1MGLLKDM4ETAS1R3 | |
| SCHEMBL12492829 | 0.86 | ALDH1A1 (0.55) | TDP1L3MBTL1MGLLKDM4ETAS1R3 | |
| SCHEMBL2585353 | 0.86 | KDM4E (0.55) | KDM4EKMT2AHPGDALDH1A1THRA | |
| SCHEMBL15731867 | 0.85 | MGLL (0.67) | TDP1L3MBTL1MGLLHPGDALDH1A1 | |
| SCHEMBL14926460 | 0.85 | MGLL (0.67) | TDP1L3MBTL1MGLLHPGDALDH1A1 |
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-2005082866-A2 | SUBSTITUTED 1, 2, 4- TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-09-09 | — | — | WO | disclosed |