Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.57 |
| ▸ | CA9 | Q16790 | 4/20 | 0.57 |
| ▸ | CA12 | O43570 | 2/20 | 0.57 |
| ▸ | PLAU | P00749 | 3/20 | 0.50 |
| ▸ | HPN | P05981 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | CA1 | P00915 | 6/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | ALB | P02768 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 3/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10482884 | 1.00 | CA2 (0.57) | CA2CA9CA12PLAUHPN | |
| SCHEMBL12169313 | 0.91 | CA2 (0.65) | CA2CA9CA12PLAUHPN | |
| SCHEMBL14539177 | 0.88 | CA2 (0.60) | CA2CA9CA12PLAUHPN | |
| SCHEMBL3185446 | 0.87 | MMP2 (0.48) | CA2CA9CA12ALDH1A1CA1 | |
| SCHEMBL29831100 | 0.86 | CA2 (0.54) | CA2CA9CA12ALDH1A1CA1 | |
| SCHEMBL7568069 | 0.86 | CA2 (0.54) | CA2CA9CA12ALDH1A1CA1 | |
| SCHEMBL12406332 | 0.86 | CA2 (0.58) | CA2CA9CA12ALDH1A1CA1 | |
| SCHEMBL30887502 | 0.85 | CA2 (0.60) | CA2CA9CA12PLAUHPN | |
| SCHEMBL1609621 | 0.84 | CA2 (0.55) | CA2CA9CA12ALDH1A1CA1 | |
| SCHEMBL1609619 | 0.84 | CA2 (0.55) | CA2CA9CA12ALDH1A1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4849414-A | HYPOTENSIVE | E. R. SQUIBB & SONS, INC. (US) | 1989-07-18 | — | — | US | disclosed |
| EP-0249445-A2 | Substituted aminoalkanoylaminoalkyl phosphonate angiotensin converting enzyme inhibitors | E.R. Squibb & Sons, Inc. (US) | 1987-12-16 | — | — | EP | disclosed |