Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | PRNP | P04156 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 5/20 | 0.45 |
| ▸ | MC5R | P33032 | 5/20 | 0.45 |
| ▸ | MC3R | P41968 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8804026 | 0.88 | MTNR1A (0.59) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL7752754 | 0.81 | TAAR1 (0.51) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL7698484 | 0.78 | MAPT (0.54) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL14074161 | 0.78 | HTR2A (0.63) | MAPTKDM4EHTR6DRD2HTR2A | |
| SCHEMBL6993933 | 0.77 | MAPT (0.49) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL8805387 | 0.76 | MTNR1A (0.48) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL3886866 | 0.75 | HTR6 (0.63) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL27683744 | 0.75 | HTR6 (0.50) | CYP1A2CYP3A4HPGDTSHRCYP2C19 | |
| SCHEMBL27962585 | 0.75 | HTR6 (0.49) | CYP1A2CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL8986642 | 0.74 | CHRNB2 (0.43) | CYP1A2CYP3A4HPGDTSHRCYP2C19 |
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-1071664-A1 | SUBSTITUTED 2-OXO-ALKANOIC ACID- 2-(INDOL-3-YL)-ETHYL] AMIDES | BAYER AG (DE) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999054301-A1 | SUBSTITUTED 2-OXO-ALKANOIC ACID-[2-(INDOL-3-YL)-ETHYL] AMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-10-28 | — | — | WO | disclosed |
| EP-0623138-A1 | NEW ADENOSINE DERIVATIVES, PREPARATION METHODS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. | UNION PHARMA SCIENT APPL (FR) | 1994-11-09 | — | — | EP | disclosed |