Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDAH1 | O94760 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.35 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.34 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.34 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7989630 | 1.00 | DDAH1 (0.41) | DDAH1EPHX2NOS3NOS1NOS2 | |
| SCHEMBL7986250 | 0.77 | NOS3 (0.39) | DDAH1EPHX2NOS3NOS1NOS2 | |
| SCHEMBL7986244 | 0.77 | NOS3 (0.39) | DDAH1EPHX2NOS3NOS1NOS2 | |
| SCHEMBL7976196 | 0.77 | CTSK (0.43) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7976200 | 0.77 | CTSK (0.43) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL30449957 | 0.72 | MAPT (0.54) | EPHX2ALDH1A1LMNAMAPTABCC4 | |
| SCHEMBL1469535 | 0.72 | MAPT (0.54) | EPHX2ALDH1A1LMNAMAPTABCC4 | |
| SCHEMBL4021318 | 0.72 | MAPT (0.54) | EPHX2ALDH1A1LMNAMAPTABCC4 | |
| SCHEMBL7987073 | 0.72 | EPHX2 (0.45) | EPHX2ALDH1A1LMNAMAPTABCC4 | |
| SCHEMBL7986467 | 0.71 | DPP4 (0.46) | EPHX2NOS3NOS1NOS2DPP4 |
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-2001040198-A2 | MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS | AVENTIS PHARMA S.A. (FR) | 2001-06-07 | — | — | WO | disclosed |