Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27582103 | 0.81 | KDR (0.40) | KDRALDH1A1GAAMAPTMEN1 | |
| SCHEMBL27582110 | 0.79 | KDR (0.35) | KDRALDH1A1GAAMAPTMEN1 | |
| SCHEMBL27582003 | 0.77 | CYP1A2 (0.38) | KDRALDH1A1GAAMAPTMEN1 | |
| SCHEMBL27561352 | 0.77 | KDR (0.47) | LMNAKDRALDH1A1GAAMAPT | |
| SCHEMBL27561356 | 0.75 | CYP1A2 (0.48) | ALDH1A1HSD17B10MEN1KMT2ACYP1A2 | |
| SCHEMBL27561679 | 0.75 | LRRK2 (0.36) | LMNAKDRALDH1A1GAAHTT | |
| SCHEMBL27582093 | 0.74 | KDR (0.40) | KDRALDH1A1HTTMAPTMEN1 | |
| SCHEMBL27564358 | 0.73 | PTGS1 (0.43) | LMNAALDH1A1GAAHSD17B10HTT | |
| SCHEMBL27561382 | 0.72 | CSNK2A1 (0.46) | ALDH1A1GAAHSD17B10MAPTMEN1 | |
| SCHEMBL27561547 | 0.72 | RAPGEF4 (0.51) | ALDH1A1GAAHSD17B10MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1351498-A | Pyrrolotriazines inhibitors of kinases | BRISTOL MYERS SQUIBB CO (US) | 2002-05-29 | — | — | CN | claimed |
| CN-1351498-B | Pyrrolotriazines inhibitors of kinases | BRISTOL MYERS SQUIBB CO | 2012-08-15 | — | — | CN | disclosed |
| CN-1351498-A | Pyrrolotriazines inhibitors of kinases | BRISTOL MYERS SQUIBB CO (US) | 2002-05-29 | — | — | CN | disclosed |