Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11317728 | 0.86 | CYP3A4 (0.33) | CYP3A4TSHRMAPK1ALDH1A1THRB | |
| SCHEMBL11789695 | 0.81 | TDP1 (0.41) | CYP3A4TDP1TSHRTP53MAPK1 | |
| SCHEMBL10788045 | 0.81 | NPC1 (0.33) | TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL11315221 | 0.79 | CYP3A4 (0.32) | CYP3A4TDP1TSHRTP53MAPK1 | |
| SCHEMBL11785540 | 0.79 | KDM4E (0.38) | TDP1MAPK1ALDH1A1MEN1KMT2A | |
| SCHEMBL11440892 | 0.78 | PTGS1 (0.39) | TSHRMAPK1ALDH1A1MEN1KMT2A | |
| SCHEMBL11305866 | 0.77 | PABPC1 (0.49) | CYP3A4TDP1TSHRTP53MAPK1 | |
| SCHEMBL11306569 | 0.76 | GAA (0.31) | KMT2A | |
| SCHEMBL10786379 | 0.75 | CYP3A4 (0.39) | CYP3A4TDP1TSHRTP53MAPK1 | |
| SCHEMBL10784612 | 0.72 | POLB (0.33) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4246181-A | HAIR DYE | L'OREAL (FR) | 1981-01-20 | — | — | US | disclosed |