Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | PRNP | P04156 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.51 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.40 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086996 | 0.85 | NPC1 (0.45) | RAB9ANPC1PRNPHDAC6CHRNA7 | |
| SCHEMBL19086231 | 0.81 | ALDH1A1 (0.56) | RAB9ANPC1HDAC6TP53GAA | |
| SCHEMBL19086350 | 0.77 | MAPT (0.48) | RAB9ANPC1HDAC6TSHRUSP2 | |
| SCHEMBL19086320 | 0.74 | KDM4E (0.56) | RAB9ANPC1TSHRTP53SMN1; SMN2 | |
| SCHEMBL3002439 | 0.74 | RAB9A (0.62) | RAB9ANPC1PRNPHDAC6CHRNA7 | |
| SCHEMBL2998158 | 0.73 | NPC1 (0.55) | RAB9ANPC1PRNPHDAC6USP2 | |
| SCHEMBL19087009 | 0.72 | ALDH1A1 (0.49) | RAB9ANPC1HDAC6TSHRTP53 | |
| SCHEMBL19086200 | 0.71 | HDAC6 (0.48) | RAB9ANPC1PRNPHDAC6ALDH1A1 | |
| SCHEMBL19086247 | 0.71 | L3MBTL1 (0.48) | RAB9ANPC1USP2GAASMN1; SMN2 | |
| SCHEMBL19086028 | 0.69 | ALDH1A1 (0.47) | HDAC6USP2SMN1; SMN2ALDH1A1PRMT5 |
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 |