Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ANO1 | Q5XXA6 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL6568647 | 0.84 | HTT (0.41) | HTTMEN1KMT2AANO1GAA | |
| SCHEMBL4345624 | 0.81 | MEN1 (0.56) | HTTMEN1KMT2AMAPK1ANO1 | |
| SCHEMBL4346771 | 0.81 | POLB (0.51) | HTTMEN1KMT2AANO1RAB9A | |
| SCHEMBL6788096 | 0.78 | HDAC1 (0.47) | MEN1KMT2ANPC1RAB9AMAPT | |
| SCHEMBL13608008 | 0.74 | ALDH1A1 (0.61) | HTTMEN1KMT2AMAPK1NPC1 | |
| SCHEMBL7488206 | 0.74 | KMT2A (0.63) | HTTMEN1KMT2ANPC1RAB9A | |
| SCHEMBL4348862 | 0.74 | HTT (0.47) | HTTMEN1KMT2AMAPK1ANO1 | |
| SCHEMBL4346777 | 0.74 | HTT (0.38) | HTTANO1NPC1GAALMNA | |
| SCHEMBL4354426 | 0.72 | NPC1 (0.47) | HTTMEN1KMT2AMAPK1ANO1 | |
| SCHEMBL5594682 | 0.72 | HTT (0.67) | HTTMEN1KMT2ANPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |