Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR39 | O43194 | 1/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 3/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2585526 | 0.77 | ACACB (0.51) | GPR39CLK4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2584992 | 0.76 | GPR39 (0.56) | GPR39CLK4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL25836238 | 0.76 | MAPK1 (0.50) | MEN1KMT2AKDM4EPIM1 | |
| SCHEMBL17634546 | 0.74 | PDE10A (0.43) | GPR39CLK4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19355384 | 0.73 | PDE10A (0.44) | GPR39CLK4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2774028 | 0.73 | S1PR1 (0.61) | GPR39MEN1KMT2AHRH4KDM4E | |
| SCHEMBL3963492 | 0.72 | KDM4E (0.47) | ALDH1A1ADORA3KDM4EHPGDTDP1 | |
| SCHEMBL3962364 | 0.72 | IRAK4 (0.46) | CLK4CYP1A2CYP3A4CYP2D6USP2 | |
| SCHEMBL18571767 | 0.72 | PTGER4 (0.44) | ALDH1A1HSD17B10ALOX15MEN1KMT2A | |
| SCHEMBL5906640 | 0.71 | F11 (0.47) | GPR39CLK4CYP1A2CYP3A4CYP2D6 |
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-2009034390-A1 | HETEROCYCLIC DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C | ARROW THERAPEUTICS LIMITED (GB) | 2009-03-19 | — | — | WO | disclosed |
| WO-2009034390-A1 | HETEROCYCLIC DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C | ARROW THERAPEUTICS LIMITED (GB) | 2009-03-19 | — | — | WO | disclosed |