Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | TTR | P02766 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7792557 | 0.91 | MAOB (0.52) | MAOBALDH1A1SMN1; SMN2KDM4EHTT | |
| SCHEMBL7792264 | 0.90 | ALDH1A1 (0.56) | MAOBALDH1A1SMN1; SMN2KDM4EHTT | |
| SCHEMBL7798169 | 0.84 | NPC1 (0.63) | MAOBALDH1A1SMN1; SMN2KDM4EHTT | |
| SCHEMBL7800381 | 0.83 | MAOB (0.56) | MAOBALDH1A1SMN1; SMN2TAAR1CYP2A6 | |
| Benzaldehyde SCHEMBL7792134 | 0.81 | ALDH1A1 (0.58) | MAOBALDH1A1SMN1; SMN2KDM4EHTT | |
| SCHEMBL30644968 | 0.81 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2KDM4ETTRCYP2A6 | |
| SCHEMBL921289 | 0.81 | MAOB (0.61) | MAOBALDH1A1SMN1; SMN2KDM4EHTT | |
| SCHEMBL1874850 | 0.81 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2KDM4ETTRCYP2A6 | |
| Benzaldehyde SCHEMBL14677731 | 0.81 | TAAR1 (0.71) | MAOBALDH1A1KDM4ETAAR1NPC1 | |
| SCHEMBL7792654 | 0.80 | TAAR1 (0.58) | MAOBALDH1A1SMN1; SMN2KDM4EHTT |
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 |