Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 10/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD1 | P21728 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD5 | P21918 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4427688 | 0.83 | TDP1 (0.65) | TDP1TAAR1MEN1KMT2AMAOA | |
| SCHEMBL8240918 | 0.81 | — | — | |
| SCHEMBL931383 | 0.77 | TAAR1 (0.63) | TDP1TAAR1MAOBDRD2ALDH1A1 | |
| SCHEMBL30186558 | 0.77 | TAAR1 (0.63) | TDP1TAAR1MAOBDRD2ALDH1A1 | |
| SCHEMBL14229868 | 0.77 | TDP1 (0.52) | TDP1TAAR1MEN1KMT2ADRD2 | |
| SCHEMBL11949748 | 0.77 | CNR1 (0.42) | TAAR1DRD2DRD1OPRK1DRD4 | |
| SCHEMBL28204549 | 0.76 | TDP1 (0.56) | TDP1TAAR1MEN1KMT2AMAOA | |
| SCHEMBL30688447 | 0.74 | TAAR1 (0.65) | TDP1TAAR1MAOB | |
| SCHEMBL705920 | 0.74 | TAAR1 (0.65) | TDP1TAAR1MAOB | |
| SCHEMBL23759882 | 0.74 | SIGMAR1 (0.50) | MAOAMAOB |
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-103153994-B | Bicyclic heteroaryl kinase inhibitor and using method | UNIVERSITY OF ROCHESTER (US) | 2016-02-10 | — | — | CN | disclosed |
| CN-103153994-A | Bicyclic heteroaryl kinase inhibitors and methods of use | UNIV ROCHESTER | 2013-06-12 | — | — | CN | disclosed |