Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | SMO | Q99835 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6423341 | 0.75 | USP2 (0.49) | L3MBTL1SMOHPGDALDH1A1USP2 | |
| SCHEMBL19086231 | 0.75 | ALDH1A1 (0.56) | HPGDALDH1A1MEN1KMT2APOLB | |
| SCHEMBL6423315 | 0.74 | TPSAB1 (0.61) | L3MBTL1HPGDALDH1A1MEN1KMT2A | |
| SCHEMBL19086350 | 0.72 | MAPT (0.48) | SMOHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL19086022 | 0.71 | RAB9A (0.56) | HPGDALDH1A1MEN1KMT2AUSP2 | |
| SCHEMBL21428365 | 0.69 | PDE4D (0.44) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19086320 | 0.69 | KDM4E (0.56) | L3MBTL1HPGDALDH1A1MEN1KMT2A | |
| SCHEMBL19086996 | 0.67 | NPC1 (0.45) | ALDH1A1USP2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19087009 | 0.67 | ALDH1A1 (0.49) | L3MBTL1HPGDALDH1A1MEN1KMT2A | |
| SCHEMBL1474629 | 0.66 | HPGD (0.57) | L3MBTL1HPGDALDH1A1KMT2APOLB |
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-2017114275-A1 | COMPOUND FOR INHIBITING ROCK, PREPARATION METHOD AND USE OF SAME | 成都先导药物开发有限公司 | 2017-07-06 | — | — | WO | disclosed |