Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 10/20 | 0.45 |
| ▸ | ACE | P12821 | 7/20 | 0.45 |
| ▸ | CPA1 | P15085 | 7/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP7 | P09237 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | FPR2 | P25090 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7416053 | 1.00 | MME (0.45) | MMEACECPA1ACE2ALDH1A1 | |
| SCHEMBL27534943 | 0.86 | POLB (0.50) | MMEACECPA1ACE2ALDH1A1 | |
| SCHEMBL5570713 | 0.86 | POLB (0.50) | MMEACECPA1ACE2ALDH1A1 | |
| SCHEMBL7416066 | 0.80 | MME (0.47) | MMEACECPA1ACE2ALDH1A1 | |
| SCHEMBL7416062 | 0.80 | MME (0.47) | MMEACECPA1ACE2ALDH1A1 | |
| SCHEMBL5573305 | 0.75 | ACE (0.45) | ACEALDH1A1CA1CA2CA5A | |
| SCHEMBL27514797 | 0.75 | ACE (0.45) | ACEALDH1A1CA1CA2CA5A | |
| SCHEMBL27541181 | 0.74 | NPSR1 (0.48) | MMEACEACE2ALDH1A1MMP2 | |
| SCHEMBL5850598 | 0.74 | NPSR1 (0.48) | MMEACEACE2ALDH1A1MMP2 | |
| SCHEMBL29670354 | 0.74 | MME (0.63) | MMEACECPA1ACE2MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0994895-A1 | DIPEPTIDE COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | Elan Pharmaceuticals, Inc. (US) | 2000-04-26 | — | — | EP | disclosed |
| WO-1999006435-A1 | DIPEPTIDE COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 1999-02-11 | — | — | WO | disclosed |