Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 2/20 | 0.31 |
| ▸ | CCND3 | P30281 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | UPP1 | Q16831 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5379432 | 0.80 | CDK4 (0.33) | MEN1KMT2ACDK4CCND3UPP1 | |
| SCHEMBL3831428 | 0.80 | HTT (0.37) | MEN1KMT2AHTTATM | |
| SCHEMBL23768908 | 0.80 | UPP1 (0.35) | MEN1KMT2ACDK4CCND3UPP1 | |
| SCHEMBL3830239 | 0.77 | ALDH1A1 (0.43) | MEN1KMT2AHTTATM | |
| SCHEMBL23754325 | 0.77 | TTR (0.36) | TTRALBCDK4CCND3UPP1 | |
| SCHEMBL17508469 | 0.77 | PLAU (0.36) | MEN1KMT2AHTTCDK4CCND3 | |
| SCHEMBL8648853 | 0.77 | HTT (0.47) | MEN1KMT2AHTTCDK4CCND3 | |
| SCHEMBL25322816 | 0.77 | AKR1B1 (0.31) | — | |
| SCHEMBL5752177 | 0.74 | NQO2 (0.30) | — | |
| SCHEMBL31613426 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016021742-A1 | HETEROCYCLIC COMPOUNDS AS EP4 RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-02-11 | — | — | WO | disclosed |
| WO-2016021742-A1 | HETEROCYCLIC COMPOUNDS AS EP4 RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-02-11 | — | — | WO | disclosed |