Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 9/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9510175 | 0.97 | ACACB (0.39) | TSHRHSD17B10ACACBGLASMN1; SMN2 | |
| SCHEMBL9510052 | 0.96 | TSHR (0.41) | TSHRHSD17B10ACACBS1PR1MAPT | |
| SCHEMBL9512408 | 0.94 | HSD17B10 (0.47) | TSHRHSD17B10ACACBS1PR1CYP3A4 | |
| SCHEMBL9508712 | 0.94 | ACACB (0.41) | TSHRHSD17B10ACACB | |
| SCHEMBL9512419 | 0.94 | TSHR (0.37) | TSHRHSD17B10ACACBS1PR1 | |
| SCHEMBL9510178 | 0.93 | HSD17B10 (0.49) | TSHRHSD17B10ACACBS1PR1CYP3A4 | |
| SCHEMBL9511406 | 0.93 | HSD17B10 (0.49) | TSHRHSD17B10ACACBS1PR1CYP3A4 | |
| SCHEMBL9508854 | 0.93 | TSHR (0.39) | TSHRHSD17B10ACACBS1PR1CYP3A4 | |
| SCHEMBL9508718 | 0.92 | ACACB (0.39) | TSHRHSD17B10ACACBCYP3A4GLA | |
| SCHEMBL9511483 | 0.91 | TSHR (0.44) | TSHRHSD17B10ACACBCYP3A4SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |