Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | RXRG | P48443 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Phenethylamine SCHEMBL7800387 | 0.92 | TAAR1 (0.44) | RXRARXRBRXRGTAAR1NR4A2 | |
| 4-Methylbenzoic Acid SCHEMBL7798106 | 0.91 | SRD5A2 (0.41) | RXRARXRBRXRGTAAR1NR4A2 | |
| 4-Methylbenzoic Acid SCHEMBL7802556 | 0.91 | SRD5A2 (0.46) | NR4A2SRD5A2MEN1KMT2A | |
| 4-Methylbenzoic Acid SCHEMBL7792518 | 0.90 | SCN5A (0.40) | RXRARXRBRXRGTAAR1SRD5A2 | |
| Phenethylamine SCHEMBL7799179 | 0.90 | RXRA (0.52) | RXRARXRBRXRGTAAR1GPR52 | |
| Phenethylamine SCHEMBL7799012 | 0.89 | RXRA (0.42) | RXRARXRBRXRGTAAR1NR4A2 | |
| 4-Methylbenzoic Acid SCHEMBL8025639 | 0.89 | TAAR1 (0.42) | RXRARXRBRXRGTAAR1NR4A2 | |
| 4-Methylbenzoic Acid SCHEMBL7792499 | 0.88 | TAAR1 (0.47) | TAAR1NR4A2ALDH1A1MEN1KMT2A | |
| 4-Methylbenzoic Acid SCHEMBL8035699 | 0.87 | MAOB (0.43) | RXRARXRBRXRGNR4A2SRD5A2 | |
| Phenethylamine SCHEMBL7801605 | 0.86 | TAAR1 (0.53) | TAAR1SMN1; SMN2 |
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 |