Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR1 | Q92633 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28431958 | 0.80 | TSHR (0.40) | MAPTTP53POLBTSHRMAPK1 | |
| SCHEMBL22252655 | 0.79 | LPAR1 (0.43) | LPAR1MAPTTP53POLBNPSR1 | |
| SCHEMBL28435767 | 0.77 | KDM4E (0.39) | LPAR1MAPTKDM4EL3MBTL1CHRM1 | |
| SCHEMBL13318411 | 0.64 | IDO1 (0.55) | POLBTSHRMAPK1IDO1 | |
| SCHEMBL24687513 | 0.63 | TSHR (0.50) | TSHRNPSR1KDM4EPKMRAB9A | |
| SCHEMBL22252728 | 0.62 | LPAR1 (0.43) | LPAR1MAPTTSHRNPSR1PKM | |
| SCHEMBL10824498 | 0.60 | SMN1; SMN2 (0.41) | MAPTPOLBTSHRALOX15NPSR1 | |
| SCHEMBL14235847 | 0.59 | KDM4E (0.38) | MAPTTP53POLBTSHRMAPK1 | |
| SCHEMBL17100329 | 0.57 | IDO1 (0.54) | MAPTTSHRMAPK1ALOX15IDO1 | |
| SCHEMBL2647877 | 0.57 | PDK2 (0.50) | TSHRMAPK1NPSR1IDO1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-112654606-A | Triazole compound and preparation method and application thereof | 武汉朗来科技发展有限公司 | 2021-04-13 | — | — | CN | disclosed |
| CN-111434653-A | Triazole compound and preparation method and application thereof | 武汉朗来科技发展有限公司 | 2020-07-21 | — | — | CN | disclosed |