Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15093846 | 0.82 | AR (0.48) | ARALDH1A1HTTSMN1; SMN2KDM4E | |
| SCHEMBL5780286 | 0.79 | PARP1 (0.44) | ARALDH1A1HTTSMN1; SMN2KDM4E | |
| SCHEMBL17619356 | 0.76 | AR (0.48) | ARALDH1A1KDM4EDAOP2RX7 | |
| SCHEMBL15622305 | 0.75 | AR (0.47) | ARALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL17619354 | 0.74 | AR (0.49) | ARALDH1A1SMN1; SMN2KDM4EMEN1 | |
| SCHEMBL16781994 | 0.73 | ALDH1A1 (0.47) | ARALDH1A1HTTSMN1; SMN2DAO | |
| SCHEMBL20976756 | 0.71 | AR (0.43) | ARALDH1A1KDM4EDAOP2RX7 | |
| SCHEMBL20578752 | 0.71 | AR (0.52) | ARALDH1A1HTTKDM4EDAO | |
| SCHEMBL4535793 | 0.70 | AR (0.48) | ARALDH1A1HTTSMN1; SMN2KDM4E | |
| SCHEMBL5779565 | 0.70 | L3MBTL1 (0.48) | ARALDH1A1SMN1; SMN2KDM4EKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2897953-B1 | SGC STIMULATORS | IRONWOOD PHARMACEUTICALS INC (US) | 2019-05-08 | — | — | EP | disclosed |
| EP-1678181-A2 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS, INC. (US) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042534-A2 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS, INC. (US) | 2005-05-12 | — | — | WO | disclosed |