Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.34 |
| ▸ | RAB9A | P51151 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3555267 | 0.84 | ALDH1A1 (0.34) | NPC1RAB9AALDH1A1KDM4EHTT | |
| SCHEMBL4592596 | 0.83 | MAP4K1 (0.36) | NPC1RAB9AALDH1A1KDM4EHTT | |
| SCHEMBL21820452 | 0.80 | LMNA (0.46) | NPC1RAB9AALDH1A1KDM4EKMT2A | |
| SCHEMBL29833073 | 0.80 | LMNA (0.46) | NPC1RAB9AALDH1A1KDM4EKMT2A | |
| SCHEMBL4633246 | 0.79 | LMNA (0.42) | NPC1RAB9AALDH1A1KDM4EHTT | |
| SCHEMBL31497731 | 0.76 | BRD4 (0.47) | HDAC1MAPTBRD4 | |
| SCHEMBL4633318 | 0.74 | MAP4K1 (0.34) | ALDH1A1 | |
| SCHEMBL5901177 | 0.73 | KDM4E (0.30) | ALDH1A1KDM4EHTTGAAPABPC1 | |
| SCHEMBL17875680 | 0.73 | EGFR (0.46) | NPC1RAB9AALDH1A1KDM4EHTT | |
| SCHEMBL4662880 | 0.72 | BRD4 (0.50) | NPC1RAB9AALDH1A1MEN1KMT2A |
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-2008017466-A1 | PHARMACEUTICALLY ACTIVE TETRAHYDROISOQUINOLINE-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | NYCOMED GMBH (DE) | 2008-02-14 | — | — | WO | disclosed |