Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | HRH1 | P35367 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.53 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.53 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.53 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.52 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.52 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27141501 | 0.96 | CA2 (0.57) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29148318 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29113655 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29272712 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL18641746 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29065685 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29099719 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29113621 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29024152 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 | |
| SCHEMBL29024122 | 0.94 | GRIK1 (0.58) | CA2MAPK1CHRM1AKR1A1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2432318-A1 | BIMACROCYCLIC HCV NS3 PROTEASE INHIBITORS | Sequoia Pharmaceuticals, Inc. (US) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010135748-A1 | BIMACROCYCLIC HCV NS3 PROTEASE INHIBITORS | SEQUOIA PHARMACEUTICALS INC. (US) | 2010-11-25 | — | — | WO | disclosed |
| US-5075043-A | Liquid crystals | EASTMAN KODAK COMPANY (US) | 1991-12-24 | — | — | US | disclosed |
| EP-0370922-A2 | An optical article containing a linear condensation polymer exhibiting a high level of second order polarization susceptibility | EASTMAN KODAK COMPANY (US) | 1990-05-30 | — | — | EP | disclosed |