Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 7/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | USP2 | O75604 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7742191 | 0.82 | CES1 (0.39) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL10979960 | 0.79 | CES1 (0.39) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL7741295 | 0.79 | TXNRD1 (0.52) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL11104716 | 0.78 | CES1 (0.36) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL10746293 | 0.78 | TOP1 (0.51) | ALDH1A1TDP1CES1MEN1KMT2A | |
| SCHEMBL7741285 | 0.77 | TXNRD1 (0.50) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL20493758 | 0.77 | TXNRD1 (0.50) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL7741289 | 0.77 | CES1 (0.38) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL30461976 | 0.77 | CA1 (0.42) | ALDH1A1HPGDHSD17B10CYP3A4TDP1 | |
| SCHEMBL25239102 | 0.75 | LMNA (0.41) | ALDH1A1HPGDHSD17B10CYP3A4CES1 |
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-1999060992-A1 | DIRECT HAIR DYE AND THE USE THEREOF | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1999-12-02 | — | — | WO | disclosed |