Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 6/20 | 0.34 |
| ▸ | EGLN2 | Q96KS0 | 3/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3882893 | 0.80 | TSHR (0.44) | TSHRARALDH1A1MAOAMAOB | |
| SCHEMBL410450 | 0.80 | TSHR (0.44) | TSHRTRPV4AREGLN2CYP11B1 | |
| SCHEMBL13199476 | 0.78 | TSHR (0.43) | TSHRTRPV4AREGLN2CYP11B1 | |
| SCHEMBL17545789 | 0.77 | TSHR (0.41) | TSHRTRPV4AREGLN2CYP11B1 | |
| SCHEMBL19628965 | 0.75 | AR (0.41) | TSHRTRPV4ARALDH1A1 | |
| SCHEMBL152425 | 0.75 | AR (0.40) | TSHRTRPV4AREGLN2CYP11B1 | |
| SCHEMBL21860014 | 0.75 | AR (0.41) | TSHRTRPV4ARALDH1A1 | |
| SCHEMBL1222533 | 0.75 | TSHR (0.40) | TSHRTRPV4AREGLN2CYP11B1 | |
| SCHEMBL28201225 | 0.75 | TSHR (0.40) | TSHRTRPV4AREGLN2CYP11B1 | |
| SCHEMBL26094546 | 0.75 | TSHR (0.40) | TSHRARALDH1A1MAOAMAOB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024099269-A1 | ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, USE THEREOF | 华东师范大学 | 2024-05-16 | — | — | WO | disclosed |
| CN-118026880-A | Aryl amide compound, pharmaceutical composition containing same and application thereof | 华东师范大学 | 2024-05-14 | — | — | CN | disclosed |
| WO-2001079195-A2 | PYRIDINE AND PYRAZINE DERIVATIVES AS THROMBIN INHIBITORS | CORVAS INTERNATIONAL, INC. (US) | 2001-10-25 | — | — | WO | disclosed |
| WO-2001079193-A2 | SUBSTITUTED HYDRAZINYL HETEROAROMATIC INHIBITORS OF THROMBIN | CORVAS INTERNATIONAL, INC. (US) | 2001-10-25 | — | — | WO | disclosed |
| WO-2001079261-A1 | TETRAHYDRO-AZEPINONE DERIVATIVES AS THROMBIN INHIBITORS | CORVAS INTERNATIONAL, INC. (US) | 2001-10-25 | — | — | WO | disclosed |