Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL5360124 | 0.84 | NPC1 (0.50) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL19716281 | 0.81 | NPC1 (0.48) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL3076334 | 0.81 | NPC1 (0.47) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL3083355 | 0.80 | NPC1 (0.46) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL3082411 | 0.80 | NPC1 (0.46) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL4376014 | 0.76 | TSHR (0.45) | KDM4EALDH1A1NPC1RAB9AL3MBTL1 | |
| SCHEMBL19730343 | 0.74 | UCHL1 (0.42) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL23496544 | 0.72 | NPC1 (0.48) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL1562700 | 0.72 | MAPT (0.45) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL2304085 | 0.72 | NPC1 (0.68) | KDM4EALDH1A1NPC1RAB9AHSD17B10 |
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-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |