Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
| ▸ | RXRG | P48443 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | MRGPRX1 | Q96LB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3722554 | 0.85 | P2RY1 (0.39) | P2RY1SMN1; SMN2KDM4EMAPTUSP2 | |
| SCHEMBL3720603 | 0.80 | MRGPRX1 (0.42) | P2RY1LTA4HPTGS2MRGPRX1 | |
| SCHEMBL3722454 | 0.76 | P2RY1 (0.39) | P2RY1LTA4HPTGS2MRGPRX1 | |
| SCHEMBL3718259 | 0.74 | SLC22A12 (0.43) | P2RY1LTA4HPTGS2 | |
| SCHEMBL3718903 | 0.74 | LTA4H (0.41) | P2RY1MAOBMRGPRX4NOTUMCDK8 | |
| SCHEMBL2782296 | 0.72 | PTGS2 (0.44) | MAPTCDK8PTGS2 | |
| SCHEMBL11423116 | 0.71 | P4HTM (0.50) | MRGPRX4RXRARXRBRXRG | |
| SCHEMBL11423110 | 0.70 | KMT2A (0.50) | SMN1; SMN2KMT2AMAOBLTA4HPTGS2 | |
| SCHEMBL14150163 | 0.69 | LTA4H (0.45) | P2RY1KDM4EKMT2ANOTUMRXRA | |
| SCHEMBL30134107 | 0.69 | KIF11 (0.38) | SMN1; SMN2KDM4EMAPTUSP2KMT2A |
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 |