Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6635025 | 0.79 | NPC1 (0.50) | CYP3A4NFE2L2ABCG2NPC1RAB9A | |
| SCHEMBL4864045 | 0.79 | NFE2L2 (0.72) | NFE2L2ABCG2NR1H4ARMAOB | |
| SCHEMBL8146116 | 0.77 | ABCG2 (0.69) | CYP3A4NFE2L2ABCG2NR1H4AR | |
| SCHEMBL5313681 | 0.75 | NR1H4 (0.64) | NFE2L2NR1H4ARMAOBRAB9A | |
| SCHEMBL2098153 | 0.75 | KMT2A (0.55) | NFE2L2NPC1RAB9AHPGDTP53 | |
| SCHEMBL3762150 | 0.75 | RAB9A (0.55) | NFE2L2NPC1RAB9AHPGDTP53 | |
| SCHEMBL29603325 | 0.73 | MAPT (0.59) | NPC1RAB9AHPGDTP53SMN1; SMN2 | |
| SCHEMBL341046 | 0.73 | NPC1 (0.58) | NFE2L2NPC1RAB9AHPGDTP53 | |
| SCHEMBL29931828 | 0.73 | NPC1 (0.58) | NFE2L2NPC1RAB9AHPGDTP53 | |
| SCHEMBL152563 | 0.73 | MAPT (0.59) | NPC1RAB9AHPGDTP53SMN1; SMN2 |
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-1112055-A1 | AGENTS FOR DYEING FIBRES CONTAINING KERATIN | Henkel Kommanditgesellschaft auf Aktien (DE) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000015183-A1 | AGENTS FOR DYEING FIBRES CONTAINING KERATIN | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2000-03-23 | — | — | WO | disclosed |