Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TYR | P14679 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27561675 | 0.92 | TYR (0.48) | KDRPDGFRBCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27582003 | 0.89 | CYP1A2 (0.38) | KDRPDGFRBCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27582103 | 0.79 | KDR (0.40) | KDRPDGFRBCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27582110 | 0.77 | KDR (0.35) | KDRPDGFRBMAPTCYP3A4MEN1 | |
| SCHEMBL27582076 | 0.76 | MAPT (0.49) | KDRPDGFRBCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27582045 | 0.74 | LMNA (0.45) | KDRCYP1A2CYP2D6CYP2C19MAPT | |
| SCHEMBL27561352 | 0.74 | KDR (0.47) | KDRCYP1A2MAPTMEN1TP53 | |
| SCHEMBL27561517 | 0.73 | RAPGEF4 (0.33) | MEN1KMT2A | |
| SCHEMBL27561679 | 0.73 | LRRK2 (0.36) | KDRPDGFRBMAPTMEN1HTT | |
| SCHEMBL27564358 | 0.71 | PTGS1 (0.43) | MAPTMEN1TP53ALOX15TSHR |
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-1351498-A | Pyrrolotriazines inhibitors of kinases | BRISTOL MYERS SQUIBB CO (US) | 2002-05-29 | — | — | CN | claimed |
| CN-1351498-A | Pyrrolotriazines inhibitors of kinases | BRISTOL MYERS SQUIBB CO (US) | 2002-05-29 | — | — | CN | disclosed |