Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 8/20 | 0.51 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 3/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2960489 | 0.95 | CCR1 (0.49) | CCR1CHRM4GAAMAPK1HTT | |
| SCHEMBL2959876 | 0.86 | CCR1 (0.48) | CCR1CHRM4GAAMAPK1HTT | |
| SCHEMBL10723724 | 0.80 | CHRM4 (0.64) | CHRM4MAPK1FAAHHDAC3HDAC4 | |
| SCHEMBL2956787 | 0.80 | CCR1 (0.65) | CCR1CHRM4GAAMAPK1HTT | |
| SCHEMBL6521612 | 0.80 | FAAH (0.50) | CCR1CHRM4GAAMAPK1HTT | |
| SCHEMBL2960483 | 0.78 | FAAH (0.52) | CCR1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL2960427 | 0.78 | MEN1 (0.59) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL2963394 | 0.77 | CCR1 (0.50) | CCR1CHRM4GAAMAPK1HTT | |
| SCHEMBL2960543 | 0.75 | CCR1 (0.51) | CCR1CHRM4GAAMAPK1HTT | |
| SCHEMBL2956812 | 0.74 | ALDH1A1 (0.50) | CCR1CHRM4GAAHTTNPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7759339-B2 | Hydroxysteroid dehydrogenase inhibitors | TAKEDA SAN DIEGO, INC. (US) | 2010-07-20 | — | — | US | disclosed |
| US-7759339-B2 | Hydroxysteroid dehydrogenase inhibitors | TAKEDA SAN DIEGO, INC. (US) | 2010-07-20 | — | — | US | disclosed |