Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.33 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL6047606 | 0.93 | NR1I3 (0.39) | NOTUMNPC1MAPTTSHRSMN1; SMN2 | |
| SCHEMBL5887105 | 0.92 | ESR2 (0.35) | NOTUMNPC1MAPTTSHRSMN1; SMN2 | |
| SCHEMBL5887288 | 0.90 | ALDH1A3 (0.41) | SMN1; SMN2GSK3BMAPK14 | |
| SCHEMBL5887199 | 0.90 | KMT2A (0.35) | NPC1SMN1; SMN2MAPK10 | |
| SCHEMBL6416879 | 0.87 | HPGD (0.32) | ALOX5 | |
| SCHEMBL5887750 | 0.83 | MAPK10 (0.38) | NOTUMMAPTMAPK10NR1I3GSK3B | |
| SCHEMBL6047579 | 0.82 | GRIA1 (0.31) | — | |
| SCHEMBL5887143 | 0.82 | PTGS2 (0.35) | — | |
| SCHEMBL5887667 | 0.80 | NPC1 (0.39) | NPC1MAPTTSHRSMN1; SMN2ESR2 | |
| SCHEMBL5887353 | 0.80 | MEN1 (0.35) | NPC1TSHRSMN1; SMN2CTSDBACE1 |
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-7037931-B2 | Corticotropin releasing factor moderator; analgesics; drug abruse, drug dependency; schizophrenia | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-05-02 | — | — | US | claimed |