Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MYC | P01106 | 1/20 | 0.50 |
| ▸ | MAX | P61244 | 1/20 | 0.50 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.45 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29915189 | 1.00 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| Bicarbonate SCHEMBL17325037 | 0.92 | MYC (0.44) | MYCMAXTRPM4KDM4EALDH1A1 | |
| SCHEMBL11811414 | 0.83 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL64767 | 0.80 | MYC (0.52) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL29376440 | 0.80 | MYC (0.52) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL9326676 | 0.80 | MYC (0.52) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL3291770 | 0.80 | MAOA (0.48) | NQO2CYP1A2KDM4EHPGDALDH1A1 | |
| SCHEMBL11811408 | 0.78 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL6457778 | 0.77 | KDM4E (0.51) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL18544874 | 0.77 | CYP1A2 (0.64) | CYP1A2KDM4EHPGDALDH1A1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-103857288-A | Amino-quinolines as kinase inhibitors | GLAXOSMITHKLINE LLC | 2014-06-11 | — | — | CN | disclosed |
| WO-2009143389-A1 | PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS | ARIAD PHARMACEUTICALS, INC. (US) | 2009-11-26 | — | — | WO | disclosed |