Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27448904 | 0.79 | HTT (0.33) | ESR1RAB9ANPC1MITFTP53 | |
| SCHEMBL27510709 | 0.72 | ESR1 (0.38) | ESR1TP53RECQLSMN1; SMN2NPSR1 | |
| SCHEMBL5588791 | 0.72 | CYP1A2 (0.33) | HSD17B10CYP1A2CYP2C19TSHR | |
| SCHEMBL29145217 | 0.72 | MAPT (0.34) | HSD17B10TSHR | |
| SCHEMBL28609176 | 0.71 | POLB (0.36) | ESR1RAB9AMAPK1 | |
| SCHEMBL5532399 | 0.71 | ESR1 (0.34) | ESR1RAB9ATP53RECQLSMN1; SMN2 | |
| SCHEMBL5587574 | 0.69 | MAPT (0.35) | HSD17B10CYP1A2CYP2C19TSHR | |
| SCHEMBL27388015 | 0.68 | TSHR (0.39) | SMN1; SMN2CYP1A2TSHRMAPK1CNR2 | |
| SCHEMBL28813133 | 0.68 | TSHR (0.38) | ESR1RAB9ATP53NPSR1HSD17B10 | |
| SCHEMBL23609662 | 0.67 | HCAR2 (0.38) | SMN1; SMN2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106164127-A | Organic semiconductor compound | 默克专利股份有限公司 | 2016-11-23 | — | — | CN | disclosed |