Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 7/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PPM1A | P35813 | 1/20 | 0.39 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8007736 | 0.88 | CYP19A1 (0.48) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 | |
| SCHEMBL9783835 | 0.87 | NR5A1 (0.50) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 | |
| SCHEMBL9559856 | 0.86 | CHRNA7 (0.41) | CYP2C19CYP1A2CYP2D6TSHRCYP3A4 | |
| SCHEMBL11016291 | 0.85 | LTA4H (0.53) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 | |
| SCHEMBL15067951 | 0.84 | LTA4H (0.44) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 | |
| SCHEMBL3931754 | 0.83 | CYP1A2 (0.40) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 | |
| SCHEMBL2222934 | 0.81 | NQO1 (0.42) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 | |
| SCHEMBL7072904 | 0.80 | NR5A1 (0.58) | TSHRL3MBTL1RARB | |
| SCHEMBL7072893 | 0.80 | NR5A1 (0.58) | TSHRL3MBTL1RARB | |
| SCHEMBL7116978 | 0.80 | CHRNA7 (0.46) | CYP2C19CYP1A2CYP19A1CYP2C9CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6579829-B2 | Aromatic sulfonamide compound | MITSUI CHEMICALS, INC. (JP) | 2003-06-17 | — | — | US | disclosed |
| US-20010036903-A1 | Developer composition and heat sensitive recording material | MITSUI CHEMICALS, INC. (JP) | 2001-11-01 | — | — | US | disclosed |
| EP-1138517-A2 | Developer composition and heat sensitive recording material | Mitsui Chemicals, Inc. (JP) | 2001-10-04 | — | — | EP | disclosed |