Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 8/20 | 0.45 |
| ▸ | CA1 | P00915 | 8/20 | 0.45 |
| ▸ | CA2 | P00918 | 8/20 | 0.45 |
| ▸ | CA4 | P22748 | 8/20 | 0.45 |
| ▸ | CA7 | P43166 | 8/20 | 0.45 |
| ▸ | CA9 | Q16790 | 8/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21619828 | 0.86 | ACACB (0.47) | KDM4EABL1LMNACYP3A4ACACB | |
| SCHEMBL21616612 | 0.85 | CYP3A4 (0.43) | KDM4EABL1LMNACYP3A4ACACB | |
| SCHEMBL21620073 | 0.82 | KDM4E (0.46) | KDM4EABL1LMNACA12CA1 | |
| SCHEMBL21620126 | 0.81 | KMT2A (0.47) | KDM4EABL1LMNACYP3A4ACACB | |
| SCHEMBL30474519 | 0.80 | NOTUM (0.51) | LMNACA12CA2CA9CYP3A4 | |
| SCHEMBL28537487 | 0.80 | MAPT (0.55) | KDM4EABL1LMNAACACBCYP2C9 | |
| SCHEMBL30474477 | 0.80 | MAPT (0.55) | KDM4EABL1LMNAACACBCYP2C9 | |
| SCHEMBL21616651 | 0.79 | NOTUM (0.44) | CYP3A4SCN10AAVPR1A | |
| SCHEMBL30474468 | 0.79 | NOTUM (0.44) | CYP3A4SCN10AAVPR1A | |
| SCHEMBL2514320 | 0.78 | DRD2 (0.50) | KDM4EABL1LMNACYP3A4CYP2C9 |
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-112513021-B | ROR gamma antagonist and application thereof in medicines | 广东东阳光药业有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-112513021-A | ROR gamma antagonist and application thereof in medicine | 广东东阳光药业有限公司 | 2021-03-16 | — | — | CN | disclosed |
| WO-2020011147-A1 | RORγ ANTAGONIST AND APPLICATION THEREOF IN MEDICINE | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2020-01-16 | — | — | WO | disclosed |