Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.46 |
| ▸ | HTR3B | O95264 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6933020 | 0.84 | ADRB1 (0.47) | TP53ADRB1HTR1AHTR2CHTR3A | |
| SCHEMBL6932180 | 0.81 | SIGMAR1 (0.47) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| SCHEMBL6931863 | 0.77 | ALDH1A1 (0.48) | TP53ADRB1CYP3A4HTR2AHTR2C | |
| SCHEMBL11484142 | 0.75 | CYP1A2 (0.62) | CYP1A2CYP2C9HTR3EHTR3BTP53 | |
| SCHEMBL11484136 | 0.75 | CYP1A2 (0.62) | CYP1A2CYP2C9HTR3EHTR3BTP53 | |
| SCHEMBL29253491 | 0.73 | ADRB1 (0.46) | CYP1A2CYP2C9ADRB1CYP3A4HTR1A | |
| SCHEMBL6931871 | 0.72 | TDP1 (0.50) | CYP1A2ALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL14198038 | 0.71 | FBP1 (0.53) | CYP1A2CYP2C9CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL4866408 | 0.70 | ALDH1A1 (0.48) | TP53HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL31370920 | 0.69 | FBP1 (0.50) | CYP1A2CYP2C9ALDH1A1KMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1366030-A2 | MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS | Neurogen Corporation (US) | 2003-12-03 | — | — | EP | claimed |
| WO-2002004433-A2 | MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 2002-01-17 | — | — | WO | claimed |