Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CTSG | P08311 | 1/20 | 0.32 |
| ▸ | CMA1 | P23946 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3156205 | 0.63 | BCHE (0.40) | SIGMAR1NPC1RAB9AMAPTBCHE | |
| SCHEMBL1780686 | 0.60 | MAPT (0.33) | SIGMAR1NPC1RAB9AMAPTBCHE | |
| SCHEMBL8194180 | 0.60 | MEN1 (0.42) | NPC1RAB9AMAPTPTGS2MEN1 | |
| SCHEMBL11605035 | 0.59 | NPC1 (0.45) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL11605032 | 0.59 | NPC1 (0.45) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL14541451 | 0.57 | NPC1 (0.48) | NPC1RAB9AMAPTMEN1KMT2A | |
| Benzidine SCHEMBL242358 | 0.57 | CYP3A4 (0.64) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL9834330 | 0.57 | KMT2A (0.61) | SIGMAR1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL657557 | 0.56 | SIGMAR1 (0.38) | SIGMAR1NPC1RAB9AMAPTBCHE | |
| SCHEMBL10262716 | 0.55 | GAA (0.41) | SIGMAR1NPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1728499-A1 | Composition for dyeing keratinic fibres comprising a diamino-N,N-dihydro-pyrazolone derivative and a 2,3-diaminopyridine coupler | L'OREAL (FR) | 2006-12-06 | — | — | EP | disclosed |