Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 4/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ANXA2 | P07355 | 2/20 | 0.33 |
| ▸ | S100A10 | P60903 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10688813 | 1.00 | TSHR (0.42) | TSHRSMN1; SMN2NPC1MAPTRAB9A | |
| SCHEMBL10685270 | 0.92 | TSHR (0.48) | TSHRHPGDCHRM2CHRM4CHRM3 | |
| SCHEMBL10685265 | 0.92 | TSHR (0.48) | TSHRHPGDCHRM2CHRM4CHRM3 | |
| SCHEMBL1582831 | 0.90 | TSHR (0.50) | TSHRHPGDCHRM2CHRM4CHRM3 | |
| SCHEMBL1582778 | 0.90 | TSHR (0.50) | TSHRHPGDCHRM2CHRM4CHRM3 | |
| SCHEMBL10684124 | 0.86 | TSHR (0.54) | TSHRSMN1; SMN2CHRM2CHRM4CHRM3 | |
| SCHEMBL10684133 | 0.86 | TSHR (0.54) | TSHRSMN1; SMN2CHRM2CHRM4CHRM3 | |
| SCHEMBL6135142 | 0.84 | TSHR (0.56) | TSHRSMN1; SMN2MAPTCHRM2CHRM4 | |
| SCHEMBL1120426 | 0.84 | TSHR (0.56) | TSHRSMN1; SMN2MAPTCHRM2CHRM4 | |
| SCHEMBL6482473 | 0.84 | TSHR (0.56) | TSHRSMN1; SMN2MAPTCHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4755323-A | Mixture of liquid crystalline compounds including substituted para-dioxane | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-07-05 | — | — | US | disclosed |