Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | FKBP1A | P62942 | 6/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1740752 | 0.89 | MEN1 (0.53) | POLBALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL27712915 | 0.86 | SIGMAR1 (0.47) | CYP2C19SPHK1ALDH1A1KMT2AMEN1 | |
| SCHEMBL6793000 | 0.86 | FKBP1A (0.46) | CYP2C19FKBP1AALDH1A1SIGMAR1NPSR1 | |
| SCHEMBL2438024 | 0.84 | GRM6 (0.48) | CYP2C19ALDH1A1KMT2AMEN1SIGMAR1 | |
| SCHEMBL30867774 | 0.84 | GRM6 (0.48) | CYP2C19ALDH1A1KMT2AMEN1SIGMAR1 | |
| SCHEMBL9263281 | 0.83 | FKBP1A (0.48) | FKBP1AHTR2CNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29072821 | 0.83 | HTR2C (0.50) | FKBP1AHTR2CALDH1A1NPC1RAB9A | |
| SCHEMBL7300300 | 0.83 | FKBP1A (0.48) | FKBP1AHTR2CNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5543020 | 0.83 | NAAA (0.44) | FKBP1AHTR2CNPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL6706496 | 0.83 | ALDH1A1 (0.51) | POLBALDH1A1SMN1; SMN2KMT2AMEN1 |
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-5532255-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-02 | — | — | US | disclosed |