Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | DEGS1 | O15121 | 2/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL19116525 | 0.80 | RAB9A (0.62) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL19116519 | 0.80 | DEGS1 (0.66) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL25443769 | 0.80 | PTPN1 (0.67) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL19116542 | 0.79 | SMN1; SMN2 (0.55) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL20964577 | 0.79 | RAB9A (0.75) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL2418477 | 0.78 | PTK2 (0.59) | RAB9AL3MBTL1TDP1LMNAMAPT | |
| SCHEMBL19116461 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL19116338 | 0.77 | NNMT (0.58) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL19116862 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 | |
| SCHEMBL16906924 | 0.76 | PTPN1 (0.69) | SMN1; SMN2HPGDRAB9ANPC1L3MBTL1 |
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-2017114510-A1 | COMPOUND HAVING ERK KINASE INHIBITORY ACTIVITY, METHOD FOR PREPARATION THEREOF, AND USE THEREOF | 中国科学院上海药物研究所 | 2017-07-06 | — | — | WO | disclosed |