Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TPMT | P51580 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL12586587 | 0.84 | CYP3A4 (0.49) | ALDH1A1LMNAHTTTPMTL3MBTL1 | |
| SCHEMBL23413965 | 0.81 | ALDH1A1 (0.46) | ALDH1A1LMNAHTTMAPK1RAB9A | |
| SCHEMBL9282939 | 0.77 | LMNA (0.46) | ALDH1A1LMNAHTTMAPK1RAB9A | |
| SCHEMBL9774171 | 0.75 | TPMT (0.55) | ALDH1A1LMNAHTTTPMTL3MBTL1 | |
| SCHEMBL12552999 | 0.75 | CYP3A4 (0.52) | ALDH1A1TPMTL3MBTL1HPGDKDM4E | |
| SCHEMBL5588217 | 0.75 | CYP3A4 (0.56) | ALDH1A1LMNATPMTL3MBTL1HPGD | |
| SCHEMBL9612313 | 0.75 | TUBB1 (0.44) | LMNAHTTMAPK1RAB9ATPMT | |
| SCHEMBL24717393 | 0.75 | RAB9A (0.51) | ALDH1A1LMNAHTTMAPK1RAB9A | |
| SCHEMBL9287707 | 0.75 | LMNA (0.44) | ALDH1A1LMNAHTTMAPK1RAB9A | |
| SCHEMBL31638876 | 0.74 | CYP3A4 (0.63) | ALDH1A1TPMTL3MBTL1HPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-105051028-A | Inhibitors of Bruton's tyrosine kinase | HOFFMANN LA ROCHE | 2015-11-11 | — | — | CN | disclosed |