Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | FABP4 | P15090 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL739659 | 0.89 | POLB (0.49) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL738313 | 0.87 | POLB (0.47) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL741353 | 0.87 | GRIN2B (0.57) | GRIN2BPOLBKDM4EGAAMAPK1 | |
| SCHEMBL762555 | 0.84 | KDM4E (0.59) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL740464 | 0.84 | GRIN2B (0.49) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL741501 | 0.83 | POLB (0.50) | GRIN2BPOLBKDM4EGAAMAPK1 | |
| SCHEMBL740997 | 0.82 | POLB (0.49) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL739974 | 0.81 | POLB (0.48) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL742047 | 0.81 | GRIN2B (0.57) | GRIN2BPOLBKDM4EMAPK1HTR2B | |
| SCHEMBL17533806 | 0.79 | GRIN2B (0.82) | GRIN2BPOLBKDM4EMAPK1HTR2B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | claimed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |