Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 6/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 3/20 | 0.36 |
| ▸ | EDNRB | P24530 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22748255 | 0.92 | NOTUM (0.41) | EDNRATHRBNOTUMGPBAR1CCR2 | |
| SCHEMBL22760158 | 0.81 | NOTUM (0.41) | EDNRANOTUMALDH1A1MEN1TSHR | |
| SCHEMBL22747838 | 0.81 | NOTUM (0.42) | EDNRATHRBNOTUMEDNRBALDH1A1 | |
| SCHEMBL22760426 | 0.80 | EDNRA (0.39) | EDNRACCR2EDNRBALDH1A1MEN1 | |
| SCHEMBL22760364 | 0.78 | FOLH1 (0.37) | EDNRANOTUMCCR2ALDH1A1TSHR | |
| SCHEMBL22747843 | 0.77 | MAPK8 (0.40) | EDNRATHRBNOTUMEDNRBALDH1A1 | |
| SCHEMBL22760082 | 0.77 | NOTUM (0.38) | THRBNOTUMALDH1A1MEN1KMT2A | |
| SCHEMBL22760144 | 0.76 | RPA1 (0.36) | EDNRANOTUMCCR2EDNRBKMT2A | |
| SCHEMBL22747865 | 0.76 | FOLH1 (0.35) | EDNRAALDH1A1MEN1TSHRKMT2A | |
| SCHEMBL22760085 | 0.76 | EDNRA (0.37) | EDNRATHRBALDH1A1TSHRMAPK8 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020244462-A1 | INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2020-12-10 | — | — | WO | disclosed |