Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 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 | |
|---|---|---|---|---|
| SCHEMBL7798023 | 0.89 | TAAR1 (0.57) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL7800381 | 0.88 | MAOB (0.56) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL541949 | 0.83 | ALDH1A1 (0.68) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL14134159 | 0.83 | ALDH1A1 (0.68) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL19214413 | 0.81 | ALDH1A1 (0.76) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL2911524 | 0.81 | KEAP1 (0.63) | ALDH1A1LMNASMN1; SMN2MAPTMAOB | |
| Benzaldehyde SCHEMBL7792134 | 0.80 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2CYP2A6MAOBHTT | |
| SCHEMBL2231514 | 0.80 | ALDH1A1 (0.63) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL2232493 | 0.80 | ALDH1A1 (0.63) | ALDH1A1LMNASMN1; SMN2MAPTHPGD | |
| SCHEMBL13687719 | 0.80 | LMNA (0.58) | LMNAMAPTMAOBHTTKEAP1 |
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 |