Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.38 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3721624 | 0.84 | MPO (0.44) | ADRA1AMEN1KMT2ATAAR1P2RX3 | |
| SCHEMBL3722011 | 0.82 | ADRA1A (0.43) | ADRA1AMEN1MAPTKMT2ATAAR1 | |
| SCHEMBL3726016 | 0.81 | L3MBTL1 (0.40) | ADRA1AMAPTTAAR1NPSR1HTR2A | |
| SCHEMBL10002478 | 0.79 | MAOB (0.43) | TAAR1CA12CA1CA2CA7 | |
| SCHEMBL3725866 | 0.79 | P2RX3 (0.40) | ADRA1AMEN1MAPTKMT2AKDM4E | |
| SCHEMBL3721554 | 0.79 | TAAR1 (0.38) | ADRA1AMEN1MAPTKMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL3722878 | 0.78 | MEN1 (0.40) | ADRA1AMEN1MAPTKMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL20447729 | 0.78 | MAOB (0.46) | TAAR1CA12CA1CA2CA7 | |
| SCHEMBL12239019 | 0.77 | ST14 (0.52) | ADRA1AMEN1MAPTKMT2AKDM4E | |
| SCHEMBL16853366 | 0.76 | ST14 (0.40) | ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010097373-A1 | COMPOUNDS FOR USE AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |