Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.58 |
| ▸ | MAOB | P27338 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | TTR | P02766 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Benzaldehyde SCHEMBL7798573 | 0.91 | TAAR1 (0.66) | TAAR1MAOBALDH1A1CYP2A6LTA4H | |
| SCHEMBL7792570 | 0.90 | NPC1 (0.59) | TAAR1MAOBALDH1A1LTA4HKDM4E | |
| SCHEMBL7792264 | 0.89 | ALDH1A1 (0.56) | MAOBALDH1A1CYP2A6LTA4HKDM4E | |
| SCHEMBL7800110 | 0.81 | TAAR1 (0.60) | TAAR1ALDH1A1CYP2A6KDM4ETTR | |
| SCHEMBL5604883 | 0.80 | ALDH1A1 (0.76) | TAAR1MAOBALDH1A1CYP2A6LTA4H | |
| Phenethylamine SCHEMBL22129843 | 0.80 | TAAR1 (0.84) | TAAR1MAOBCYP2A6LTA4HSMN1; SMN2 | |
| SCHEMBL740325 | 0.80 | HTR2A (0.62) | TAAR1CYP2A6LTA4HSMN1; SMN2FFAR1 | |
| SCHEMBL28527968 | 0.80 | HTR2A (0.62) | TAAR1CYP2A6LTA4HSMN1; SMN2FFAR1 | |
| Anisaldehyde SCHEMBL6814373 | 0.80 | ALDH1A1 (0.83) | ALDH1A1CYP2A6LTA4HNPC1RAB9A | |
| SCHEMBL7798169 | 0.80 | NPC1 (0.63) | MAOBALDH1A1CYP2A6LTA4HKDM4E |
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 |