Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 3/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | NMT2 | O60551 | 1/20 | 0.36 |
| ▸ | NMT1 | P30419 | 1/20 | 0.36 |
| ▸ | REN | P00797 | 3/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP7 | P09237 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 1/20 | 0.34 |
| ▸ | ECE1 | P42892 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL7904090 | 1.00 | ALDH1A1 (0.50) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11296654 | 0.98 | ALDH1A1 (0.52) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11003236 | 0.95 | LMNA (0.53) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11000070 | 0.93 | LMNA (0.57) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11001380 | 0.93 | LMNA (0.57) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11000110 | 0.93 | LMNA (0.57) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL10998003 | 0.93 | LMNA (0.57) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11003889 | 0.89 | CYP1A2 (0.39) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL11001837 | 0.87 | CYP1A2 (0.44) | ALDH1A1LMNACYP1A2CTSKCTSL | |
| SCHEMBL10998499 | 0.87 | CYP1A2 (0.44) | ALDH1A1LMNACYP1A2CTSKCTSL |
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-4522948-A | SPERMICIDAL AND SPERMATOSTATIC AGENTS | SYNTEX (U.S.A.) INC. (US) | 1985-06-11 | — | — | US | disclosed |
| EP-0064245-A1 | Spermicidal substituted 1-(cycloalkyl)alkylimidazoles | SYNTEX (U.S.A.) INC. (US) | 1982-11-10 | — | — | EP | disclosed |