Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | PRMT5 | O14744 | 11/20 | 0.51 |
| ▸ | WDR77 | Q9BQA1 | 11/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL19087009 | 0.90 | ALDH1A1 (0.49) | KDM4ESMN1; SMN2MEN1KMT2ARXFP1 | |
| SCHEMBL19086028 | 0.79 | ALDH1A1 (0.47) | KDM4ESMN1; SMN2MEN1KMT2ARXFP1 | |
| SCHEMBL19086231 | 0.79 | ALDH1A1 (0.56) | KDM4ESMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL19087008 | 0.79 | PRMT5 (0.41) | KDM4ESMN1; SMN2MEN1KMT2ARXFP1 | |
| SCHEMBL19086022 | 0.74 | RAB9A (0.56) | KDM4ESMN1; SMN2MEN1KMT2ARXFP1 | |
| SCHEMBL19086996 | 0.70 | NPC1 (0.45) | SMN1; SMN2ALDH1A1PRMT5WDR77NPC1 | |
| SCHEMBL7797683 | 0.68 | KMT2A (0.60) | KDM4ESMN1; SMN2MEN1KMT2ARXFP1 | |
| SCHEMBL19086176 | 0.67 | KDM1A (0.51) | KDM4ESMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL1174282 | 0.66 | HDAC6 (0.54) | KDM4ESMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL21428365 | 0.66 | PDE4D (0.44) | SMN1; SMN2NPC1RAB9ATSHR |
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 |