Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.39 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1722928 | 0.77 | SRC (0.37) | RAB9ANPC1GSTP1GSTM2SMN1; SMN2 | |
| SCHEMBL3890217 | 0.75 | RAB9A (0.44) | RAB9ANPC1GSTP1GSTM2SMN1; SMN2 | |
| SCHEMBL1710987 | 0.74 | AR (0.45) | RAB9ANPC1GSTP1GSTM2SMN1; SMN2 | |
| SCHEMBL21371993 | 0.70 | AR (0.52) | AR | |
| SCHEMBL1710777 | 0.70 | AR (0.40) | RAB9ANPC1SMN1; SMN2POLBKMT2A | |
| SCHEMBL276030 | 0.69 | PTGDR2 (0.48) | RAB9ANPC1SMN1; SMN2POLBKMT2A | |
| SCHEMBL1710674 | 0.69 | AR (0.42) | RAB9ANPC1SMN1; SMN2SRCAR | |
| SCHEMBL1710734 | 0.69 | AR (0.42) | RAB9ANPC1GSTP1GSTM2POLB | |
| SCHEMBL30033864 | 0.68 | ALDH1A1 (0.42) | RAB9AKMT2AALDH1A1LMNAMAPT | |
| SCHEMBL21820657 | 0.68 | CRBN (0.49) | RAB9ANPC1SMN1; SMN2POLBKMT2A |
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 |