Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 2/20 | 0.50 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | CPT1A | P50416 | 1/20 | 0.46 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.45 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | CCR2 | P41597 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.43 |
| ▸ | SMO | Q99835 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30614175 | 0.92 | EPHX2 (0.47) | AGTR1AGTR2EPHX2PPARGRECQL | |
| SCHEMBL698761 | 0.92 | EPHX2 (0.47) | AGTR1AGTR2EPHX2PPARGRECQL | |
| SCHEMBL30614172 | 0.87 | EPHX2 (0.49) | AGTR1AGTR2HTR2AHTR2CEPHX2 | |
| SCHEMBL25414085 | 0.87 | EPHX2 (0.49) | AGTR1AGTR2HTR2AHTR2CEPHX2 | |
| SCHEMBL23632579 | 0.85 | CYP11B1 (0.56) | HTR2AHTR2CEPHX2PPARGHDAC2 | |
| SCHEMBL16595434 | 0.85 | EPHX2 (0.46) | HTR2AHTR2CEPHX2PPARGRECQL | |
| SCHEMBL27787592 | 0.84 | RECQL (0.46) | EPHX2PPARGRECQLPTGER4KMO | |
| SCHEMBL6840434 | 0.84 | BRD4 (0.49) | RECQLENPP2PTGER4KMOTP53 | |
| SCHEMBL31633189 | 0.84 | EPHX2 (0.62) | EPHX2PPARGRECQLPTGER4HCAR3 | |
| SCHEMBL6840422 | 0.83 | P2RY14 (0.47) | HTR2AHTR2CEPHX2PPARGHDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113072542-B | ROR gamma t inhibitor and preparation method and application thereof | 广东东阳光药业股份有限公司 | 2024-04-05 | — | — | CN | disclosed |
| WO-2021139595-A1 | RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 东莞市东阳光新药研发有限公司 | 2021-07-15 | — | — | WO | disclosed |
| CN-113072542-A | ROR gamma t inhibitor and preparation method and application thereof | 广东东阳光药业有限公司 | 2021-07-06 | — | — | CN | disclosed |