Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17108502 | 0.78 | UHRF1 (0.46) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL25830623 | 0.76 | TDP1 (0.40) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL18934403 | 0.76 | TDP1 (0.40) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL21724896 | 0.76 | AR (0.41) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL12368480 | 0.76 | SMARCA2 (0.47) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL1097306 | 0.76 | NOS3 (0.47) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL12356608 | 0.76 | TDP1 (0.40) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL30257685 | 0.76 | NOS3 (0.47) | TDP1RECQLL3MBTL1POLBGAA | |
| SCHEMBL20197172 | 0.76 | MAPK14 (0.42) | HRH4HTR7MAPK14 | |
| SCHEMBL24784257 | 0.73 | TDP1 (0.38) | TDP1RECQLL3MBTL1POLBGAA |
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-107849039-A | The aminopyridine compounds substituted through heteroaryl | 百时美施贵宝公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-104169275-A | Triazolyl-substituted pyridyl compounds useful as kinase inhibitors | BRISTOL MYERS SQUIBB CO | 2014-11-26 | — | — | CN | disclosed |
| CN-104159896-A | Heterocyclic-substituted pyridyl compounds useful as kinase inhibitors | BRISTOL MYERS SQUIBB CO | 2014-11-19 | — | — | CN | disclosed |