Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | IDO1 | P14902 | 1/20 | 0.54 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11785311 | 0.93 | CYP3A4 (0.61) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL31037856 | 0.93 | CYP3A4 (0.61) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL11416802 | 0.88 | MAPT (0.50) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL10400673 | 0.86 | CYP3A4 (0.72) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL11117743 | 0.86 | CYP3A4 (0.72) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL1993642 | 0.86 | CYP3A4 (0.72) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL848233 | 0.84 | CYP3A4 (0.69) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL1995555 | 0.83 | CYP3A4 (0.60) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL11037999 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 | |
| SCHEMBL11796394 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRHIF1ACYP1A2CYP2D6 |
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-20090263655-A1 | DYE MIXTURES | HUNTSMAN INTERNATIONAL LLC (US) | 2009-10-22 | — | — | US | disclosed |