Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | MC5R | P33032 | 5/20 | 0.50 |
| ▸ | MC4R | P32245 | 4/20 | 0.50 |
| ▸ | MC1R | Q01726 | 4/20 | 0.50 |
| ▸ | MC3R | P41968 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL11887346 | 0.87 | CYP2D6 (0.79) | CYP2D6CYP1A2CYP2C19SIGMAR1LMNA | |
| SCHEMBL4363764 | 0.83 | BCHE (0.49) | CYP2D6CYP1A2CYP2C19SIGMAR1MC5R | |
| SCHEMBL4823146 | 0.80 | CYP2D6 (0.50) | CYP2D6CYP1A2CYP2C19SIGMAR1LMNA | |
| SCHEMBL16256972 | 0.79 | CYP2D6 (0.71) | CYP2D6CYP1A2CYP2C19SIGMAR1LMNA | |
| SCHEMBL14149518 | 0.79 | SIGMAR1 (0.63) | CYP1A2SIGMAR1SLC6A2SLC6A4ACHE | |
| SCHEMBL18085060 | 0.78 | CYP2D6 (0.65) | CYP2D6CYP1A2CYP2C19SIGMAR1LMNA | |
| SCHEMBL8088645 | 0.78 | SIGMAR1 (0.61) | CYP1A2SIGMAR1SLC6A2SLC6A4ACHE | |
| SCHEMBL10932466 | 0.77 | CYP2D6 (1.00) | CYP2D6CYP1A2CYP2C19SIGMAR1LMNA | |
| SCHEMBL6465969 | 0.76 | PYCR1 (0.61) | CYP1A2SIGMAR1SLC6A2SLC6A4ACHE | |
| SCHEMBL13381683 | 0.76 | CYP2D6 (0.76) | CYP2D6CYP1A2CYP2C19SIGMAR1LMNA |
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-1644337-A1 | MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF | Gene Logic, Inc. (US) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005121100-A1 | MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF | GENE LOGIC INC. (US) | 2005-12-22 | — | — | WO | disclosed |