Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 4/20 | 0.44 |
| ▸ | ANPEP | P15144 | 3/20 | 0.44 |
| ▸ | PEPD | P12955 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 4/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 4/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 4/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.35 |
| ▸ | FAP | Q12884 | 1/20 | 0.35 |
| ▸ | VHL | P40337 | 1/20 | 0.35 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1440998 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MMP2ANPEPPEPDATM | |
| SCHEMBL12098416 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MMP2ANPEPPEPDATM | |
| SCHEMBL19318679 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MMP2ANPEPPEPDATM | |
| SCHEMBL12098413 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MMP2ANPEPPEPDATM | |
| SCHEMBL4448935 | 0.84 | CTSL (0.44) | ALDH1A1MMP2ANPEPPEPDMEN1 | |
| SCHEMBL3047503 | 0.84 | CTSL (0.44) | ALDH1A1MMP2ANPEPPEPDMEN1 | |
| SCHEMBL4448932 | 0.84 | CTSL (0.44) | ALDH1A1MMP2ANPEPPEPDMEN1 | |
| SCHEMBL3047502 | 0.84 | CTSL (0.44) | ALDH1A1MMP2ANPEPPEPDMEN1 | |
| SCHEMBL8169778 | 0.82 | ALDH1A1 (0.49) | ALDH1A1MMP2ANPEPPEPDATM | |
| SCHEMBL25680532 | 0.81 | ALDH1A1 (0.52) | ALDH1A1MMP2ANPEPPEPDATM |
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-2008033389-A2 | MACROCYCLIC HCV INHIBITORS AND THEIR USES | NOVARTIS AG (CH) | 2008-03-20 | — | — | WO | disclosed |