Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.36 |
| ▸ | ARNT | P27540 | 1/20 | 0.35 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 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 | |
|---|---|---|---|---|
| SCHEMBL8311149 | 0.77 | PTGES2 (0.40) | PTGES2GRM4EGFRSLC40A1ARNT | |
| SCHEMBL897552 | 0.77 | PTGES2 (0.44) | PTGES2GRM4EGFRSLC40A1ARNT | |
| SCHEMBL21279548 | 0.76 | CES2 (0.38) | PTGES2EGFRMEN1KMT2ACSNK2A1 | |
| Hydrochloric Acid SCHEMBL31597662 | 0.76 | PTGES2 (0.42) | PTGES2GRM4EGFRSLC40A1ARNT | |
| Hydrochloric Acid SCHEMBL670310 | 0.76 | PTGES2 (0.42) | PTGES2GRM4EGFRSLC40A1ARNT | |
| SCHEMBL17948090 | 0.76 | PTGES2 (0.39) | PTGES2GRM4EGFRSLC40A1ARNT | |
| SCHEMBL320817 | 0.74 | — | — | |
| SCHEMBL21937459 | 0.73 | — | — | |
| SCHEMBL22131081 | 0.72 | MEN1 (0.41) | PTGES2GRM4SLC40A1CCR2MEN1 | |
| SCHEMBL22131082 | 0.72 | ALDH1A1 (0.38) | PTGES2GRM4CCR2CYP1A2MEN1 |
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-3312160-B1 | HEPATITIS B ANTIVIRAL AGENTS | NOVIRA THERAPEUTICS INC (US) | 2020-03-18 | — | — | EP | disclosed |
| WO-2017114500-A1 | ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY | 恩瑞生物医药科技（上海）有限公司 | 2017-07-06 | — | — | WO | disclosed |