Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRMT5 | O14744 | 10/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 10/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19085988 | 0.90 | HCRTR2 (0.40) | PRMT5WDR77SMONPC1HPGD | |
| SCHEMBL19085981 | 0.90 | TRPV1 (0.41) | PRMT5WDR77SMONPC1RAB9A | |
| SCHEMBL19085999 | 0.90 | TRPV1 (0.41) | PRMT5WDR77SMONPC1RAB9A | |
| SCHEMBL19085977 | 0.86 | NPC1 (0.45) | PRMT5WDR77KDM1ANPC1RAB9A | |
| SCHEMBL19085978 | 0.85 | ROCK2 (0.46) | PRMT5WDR77NPC1RAB9ATRPV1 | |
| SCHEMBL19085987 | 0.84 | KDM1A (0.41) | PRMT5WDR77KDM1ANPC1HPGD | |
| SCHEMBL19085990 | 0.84 | BRAF (0.40) | PRMT5WDR77SMOHDAC6 | |
| SCHEMBL19085989 | 0.82 | MAOB (0.41) | NPC1RAB9A | |
| SCHEMBL19086178 | 0.82 | NPC1 (0.38) | NPC1RAB9ATRPV1 | |
| SCHEMBL19086011 | 0.81 | KDM1A (0.43) | PRMT5WDR77KDM1ASMONPC1 |
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 |