Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9634176 | 0.81 | KDM1A (0.43) | CYP2D6CYP1A2CYP2C19CYP2C9MEN1 | |
| SCHEMBL25973017 | 0.77 | SCN9A (0.46) | CYP2D6MEN1KMT2ACHRNB2CHRNA7 | |
| SCHEMBL4149119 | 0.77 | SCN9A (0.46) | CYP2D6MEN1KMT2ACHRNB2CHRNA7 | |
| SCHEMBL25243180 | 0.74 | MEN1 (0.41) | CYP2D6CYP1A2CYP2C19CYP2C9MEN1 | |
| SCHEMBL21566690 | 0.74 | MEN1 (0.41) | CYP2D6CYP1A2CYP2C19CYP2C9MEN1 | |
| SCHEMBL19171120 | 0.74 | MEN1 (0.41) | CYP2D6CYP1A2CYP2C19CYP2C9MEN1 | |
| SCHEMBL6806512 | 0.73 | MAPT (0.41) | CYP2D6CYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL12435076 | 0.71 | CYP2D6 (0.58) | CYP2D6CYP1A2CYP2C19ALDH1A1MEN1 | |
| SCHEMBL23057911 | 0.69 | TAAR1 (0.43) | MEN1KMT2ACHRNB2CHRNA7CHRNA4 | |
| SCHEMBL29589340 | 0.69 | TAAR1 (0.43) | MEN1KMT2ACHRNB2CHRNA7CHRNA4 |
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 |