Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5887625 | 0.91 | HSP90AA1 (0.36) | MEN1KMT2ANPC1ALDH1A1TP53 | |
| SCHEMBL5887347 | 0.86 | MEN1 (0.35) | MEN1KMT2APOLBTP53 | |
| SCHEMBL6047646 | 0.85 | CYP2D6 (0.32) | ALKBH3CYP2D6CYP2C9HPGDALOX15 | |
| SCHEMBL5887191 | 0.84 | MEN1 (0.37) | MEN1KMT2APOLBNPC1TP53 | |
| SCHEMBL5887667 | 0.82 | NPC1 (0.39) | MEN1KMT2ANPC1TP53TSHR | |
| SCHEMBL5887143 | 0.81 | PTGS2 (0.35) | MEN1KMT2AALKBH3ALDH1A1RAB9A | |
| SCHEMBL6047593 | 0.80 | ALKBH3 (0.36) | ALKBH3CYP2D6CYP2C9HPGDALOX15 | |
| SCHEMBL5887653 | 0.79 | FFAR2 (0.40) | KMT2ANPC1SMN1; SMN2FFAR2HSP90AA1 | |
| SCHEMBL5887105 | 0.78 | ESR2 (0.35) | POLBNPC1TP53TSHRSMN1; SMN2 | |
| SCHEMBL5887498 | 0.78 | HSD11B1 (0.34) | MEN1KMT2APOLBCYP2D6CYP2C9 |
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 4 patents. 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 |
| JP-2006501194-A | — | — | 2006-01-12 | — | — | JP | claimed |
| EP-1525190-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-04-27 | — | — | EP | claimed |
| WO-2004007463-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-01-22 | — | — | WO | claimed |