Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 4/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8108717 | 0.83 | GBA1 (0.52) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL7919080 | 0.83 | GBA1 (0.52) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL6248843 | 0.83 | GBA1 (0.52) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL9205719 | 0.83 | GBA1 (0.52) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL27493818 | 0.78 | TACR1 (0.36) | CYP1A2CYP2D6CYP2C19TACR1TSHR | |
| SCHEMBL8156443 | 0.78 | TACR1 (0.36) | CYP1A2CYP2D6CYP2C19TACR1TSHR | |
| SCHEMBL8156441 | 0.76 | TP53 (0.54) | CYP1A2CYP2D6CYP2C19TACR1GBA1 | |
| SCHEMBL8921523 | 0.75 | TACR1 (0.38) | TACR1GBA1TSHRMEN1KMT2A | |
| SCHEMBL13966629 | 0.73 | GBA1 (0.55) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL13966630 | 0.73 | GBA1 (0.55) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6071927-A | Spiro-piperidine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LTD. (GB) | 2000-06-06 | — | — | US | disclosed |