Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.35 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | GRM8 | O00222 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL81045 | 1.00 | CYP1A2 (0.41) | CYP1A2CYP3A4BCHELMNABLM | |
| SCHEMBL83231 | 0.84 | CYP1A2 (0.43) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL83229 | 0.84 | CYP1A2 (0.43) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL83230 | 0.84 | CYP1A2 (0.43) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL81031 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL83287 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL81030 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL83288 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL81032 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4BCHEMETAP1CA12 | |
| SCHEMBL84090 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP3A4BCHEMMP1MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1765850-B1 | SUBSTITUTED PROPANE PHOSPHINIC ACID DERIVATIVES | AVENTIS PHARMA INC (US) | 2010-12-01 | — | — | EP | claimed |
| EP-1765850-B1 | SUBSTITUTED PROPANE PHOSPHINIC ACID DERIVATIVES | AVENTIS PHARMA INC (US) | 2010-12-01 | — | — | EP | disclosed |
| EP-1765850-A1 | SUBSTITUTED PROPANE PHOSPHINIC ACID DERIVATIVES | Aventis Pharmaceuticals, Inc. (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2005118618-A1 | SUBSTITUTED PROPANE PHOSPHINIC ACID DERIVATIVES | AVENTIS PHARMACEUTICALS INC. (US) | 2005-12-15 | — | — | WO | disclosed |