Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.34 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4217485 | 0.76 | ALDH1A1 (0.45) | SMN1; SMN2 | |
| SCHEMBL18912338 | 0.76 | CA2 (0.45) | CA2CA12CA1CA9HPGD | |
| SCHEMBL12005408 | 0.74 | USP2 (0.58) | CA2CA12CA1CA9HPGD | |
| SCHEMBL8286 | 0.74 | USP2 (0.58) | CA2CA12CA1CA9HPGD | |
| SCHEMBL1225127 | 0.74 | USP2 (0.58) | CA2CA12CA1CA9HPGD | |
| SCHEMBL587550 | 0.74 | USP2 (0.58) | CA2CA12CA1CA9HPGD | |
| Urea SCHEMBL2677593 | 0.74 | USP2 (0.53) | HPGDUSP2SMN1; SMN2MAPK1 | |
| SCHEMBL22234374 | 0.74 | HPGD (0.41) | CA2CA12CA1CA9HPGD | |
| Hydrochloric Acid SCHEMBL1904026 | 0.73 | USP2 (0.56) | CA2CA12CA1CA9HPGD | |
| SCHEMBL14653343 | 0.73 | USP2 (0.56) | CA2CA12CA1CA9HPGD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105175396-B | 4 methoxyl group N of substitution3The diamine compound of (base of pyrimidine 2) benzene 1,3 and its salt | 阿斯利康(瑞典)有限公司 | 2018-01-16 | — | — | CN | claimed |
| CN-105348266-B | 3 chlorine N [3 (the base amino of the pyrimidine 2) phenyl] propionamides or its salt of substitution | 阿斯利康(瑞典)有限公司 | 2018-04-10 | — | — | CN | disclosed |
| CN-105198862-B | The substituted amines of N (nitrobenzophenone of 4 fluorine, 2 methoxyl group 5) pyrimidine 2 and its salt | 阿斯利康(瑞典)有限公司 | 2018-01-23 | — | — | CN | disclosed |
| CN-105175396-B | 4 methoxyl group N of substitution3The diamine compound of (base of pyrimidine 2) benzene 1,3 and its salt | 阿斯利康(瑞典)有限公司 | 2018-01-16 | — | — | CN | disclosed |
| CN-105254616-B | The substituted amines of N (nitrobenzophenone of 2 methoxyl group 5) pyrimidine 2 and its salt | 阿斯利康(瑞典)有限公司 | 2017-10-17 | — | — | CN | disclosed |
| CN-104109151-B | Polymorphism of mesylate of N-(2-{2- dimethylamino ethyl-methylamino}-4-methoxyl-5-{[4-(1-methylindole-3-radical)pyrimidine-2-radical]amino} phenyl)2-acrylamide | 阿斯利康(瑞典)有限公司 | 2017-04-12 | — | — | CN | disclosed |