Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.36 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.36 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.33 |
| ▸ | CTSB | P07858 | 3/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL1710658 | 0.77 | RAB9A (0.41) | SRCGSTP1GSTM2ALDH1A1KMT2A | |
| SCHEMBL1710987 | 0.71 | AR (0.45) | SRCGSTP1GSTM2KMT2ADAO | |
| SCHEMBL12283515 | 0.71 | SRC (0.51) | SRCALDH1A1SMN1; SMN2 | |
| SCHEMBL26507173 | 0.70 | POLB (0.47) | ERN1ALDH1A1KMT2ACXCR2CYP1A2 | |
| SCHEMBL268584 | 0.69 | PTGS2 (0.41) | SRCERN1KMT2ALMNA | |
| SCHEMBL13400236 | 0.68 | AR (0.41) | PDE7ACTSBALDH1A1DAOAR | |
| SCHEMBL80348 | 0.67 | ALDH1A1 (0.43) | GSTP1GSTM2PDE7ACTSBALDH1A1 | |
| Cyclohexylamine SCHEMBL7798543 | 0.67 | ERN1 (0.43) | SRCERN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL1722332 | 0.66 | AR (0.42) | ALDH1A1AR | |
| SCHEMBL12283619 | 0.66 | HPGD (0.44) | SRCERN1ALDH1A1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2344451-A2 | SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2011-07-20 | — | — | EP | disclosed |
| WO-2010028088-A2 | SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2010-03-11 | — | — | WO | disclosed |