Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | IP6K1 | Q92551 | 3/20 | 0.35 |
| ▸ | IP6K3 | Q96PC2 | 3/20 | 0.35 |
| ▸ | IP6K2 | Q9UHH9 | 3/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 5/20 | 0.33 |
| ▸ | DUSP3 | P51452 | 3/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | LIFR | P42702 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | BRD2 | P25440 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL3712570 | 0.93 | CYP2C9 (0.36) | CYP2C9CYP2C19IP6K1IP6K3IP6K2 | |
| SCHEMBL3708502 | 0.92 | IP6K1 (0.40) | IP6K1IP6K3IP6K2NR1H4DUSP3 | |
| SCHEMBL3702769 | 0.92 | S1PR1 (0.38) | PDE4BNR1H4CTSACHRNA7 | |
| SCHEMBL3705512 | 0.89 | LPAR1 (0.39) | PDE4BNR1H4 | |
| SCHEMBL2336147 | 0.88 | NR1H4 (0.42) | IP6K1IP6K3IP6K2NR1H4DUSP3 | |
| SCHEMBL3714488 | 0.87 | L3MBTL1 (0.34) | CYP2C9CYP2C19 | |
| SCHEMBL3705734 | 0.86 | KMO (0.39) | IP6K1IP6K3IP6K2NR1H4LIFR | |
| SCHEMBL3714395 | 0.85 | NR1H4 (0.40) | NR1H4 | |
| SCHEMBL3707761 | 0.85 | DUSP3 (0.35) | CYP2C9NR1H4DUSP3CTSAPTPN1 | |
| SCHEMBL3707635 | 0.84 | CTSA (0.35) | PDE4BADRB2ADRB1ADRB3CTSA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010077882-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | AMIRA PHARMACEUTICALS, INC. (US) | 2010-07-08 | — | — | WO | claimed |
| WO-2010077882-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | AMIRA PHARMACEUTICALS, INC. (US) | 2010-07-08 | — | — | WO | disclosed |