Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | KDR | P35968 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL20472469 | 0.87 | CHRNA7 (0.76) | CYP1A2ALDH1A1MEN1KMT2ACHRNA7 | |
| SCHEMBL29776952 | 0.87 | CHRNA7 (0.76) | CYP1A2ALDH1A1MEN1KMT2ACHRNA7 | |
| SCHEMBL13613542 | 0.86 | KDR (0.69) | CYP1A2ALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL3673117 | 0.86 | CHRNA7 (0.60) | CYP1A2ALDH1A1MEN1KMT2ACHRNA7 | |
| SCHEMBL13541769 | 0.85 | CA12 (0.69) | MEN1KMT2ARAB9ANPC1LMNA | |
| SCHEMBL11007737 | 0.84 | MEN1 (0.61) | CYP1A2ALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL3681047 | 0.83 | CHRNA7 (0.67) | CYP1A2ALDH1A1MEN1KMT2ACHRNA7 | |
| SCHEMBL11191891 | 0.83 | KDR (0.61) | CYP1A2ALDH1A1MEN1KMT2ACHRNA7 | |
| SCHEMBL16946637 | 0.82 | EPHX2 (0.81) | MEN1KMT2ARAB9ANPC1LMNA | |
| SCHEMBL4247303 | 0.82 | MEN1 (0.64) | ALDH1A1MEN1KMT2ARAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1957077-B1 | SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS | BAYER HEALTHCARE LLC (US) | 2014-01-22 | — | — | EP | disclosed |