Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.44 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Cyclohexylamine SCHEMBL7801607 | 1.00 | ALDH1A1 (0.50) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Cyclohexylamine SCHEMBL7792667 | 0.91 | ALDH1A1 (0.45) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Cyclohexylamine SCHEMBL8035658 | 0.86 | ALDH1A1 (0.41) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Cyclohexylamine SCHEMBL8035657 | 0.86 | ALDH1A1 (0.41) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Cyclohexylamine SCHEMBL7801590 | 0.84 | HRH3 (0.48) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| SCHEMBL541949 | 0.83 | ALDH1A1 (0.68) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| SCHEMBL14134159 | 0.83 | ALDH1A1 (0.68) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Lysine SCHEMBL8039344 | 0.82 | ITGB3 (0.43) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Lysine SCHEMBL8039342 | 0.82 | ITGB3 (0.43) | ALDH1A1MAPTLMNAHPGDSMN1; SMN2 | |
| Anisaldehyde SCHEMBL7800096 | 0.80 | ALDH1A1 (0.63) | ALDH1A1CYP1A2CYP2C19KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1076649-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 2001-02-21 | — | — | EP | disclosed |
| US-6127381-A | A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY | LION BIOSCIENCE AG (DE) | 2000-10-03 | — | — | US | disclosed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | disclosed |