Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP5 | P45974 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 7/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3734266 | 0.82 | HSD17B3 (0.56) | HSD17B3ESR1ESR2SMN1; SMN2CYP2C9 | |
| SCHEMBL27798133 | 0.79 | HTR7 (0.56) | HSD17B3ESR1ESR2HPGDNPC1 | |
| SCHEMBL27798187 | 0.79 | HDAC3 (0.41) | HSD17B3ESR1ESR2RAB9AHTR7 | |
| SCHEMBL39274 | 0.79 | CES2 (0.55) | HSD17B3ESR1ESR2CES2CES1 | |
| SCHEMBL27819285 | 0.77 | ABAT (0.39) | HSD17B3ESR1ESR2HTR7CES2 | |
| SCHEMBL7871320 | 0.74 | CA2 (0.52) | SMN1; SMN2 | |
| SCHEMBL27819250 | 0.74 | HDAC1 (0.47) | ESR1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5566974 | 0.74 | USP5 (0.66) | USP5HSD17B3HPGDNPC1RAB9A | |
| SCHEMBL8412560 | 0.72 | CES2 (0.57) | HSD17B3ESR1CES2CES1 | |
| SCHEMBL27547471 | 0.70 | EPHX1 (0.45) | USP5HSD17B3HTTHPGDNPC1 |
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-101851176-B | Organic metal iridium catalyst with nitrone ligand | JIANGSU SINOCOMPOUND CATALYST CO LTD | 2013-07-03 | — | — | CN | disclosed |
| CN-101851176-A | Novel nitrone ligand, organic metal iridium catalyst and preparation method and application thereof | SUZHOU SINOCOMPOUND TECHNOLOGY CO LTD | 2010-10-06 | — | — | CN | disclosed |