Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9713085 | 1.00 | ACACB (0.48) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9713233 | 1.00 | ACACB (0.48) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9713349 | 0.99 | ACACB (0.49) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9712775 | 0.95 | ACACB (0.50) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9713193 | 0.90 | ACACB (0.52) | ACACBMAPTFFAR1FFAR4SMN1; SMN2 | |
| SCHEMBL10515393 | 0.90 | ACACB (0.46) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9713352 | 0.90 | ACACB (0.46) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9712998 | 0.90 | ACACB (0.46) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9713536 | 0.90 | ACACB (0.46) | ACACBMAPTRAB9AL3MBTL1CASP3 | |
| SCHEMBL9713710 | 0.89 | ACACB (0.47) | ACACBMAPTRAB9AL3MBTL1CASP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5164114-A | LIQUID CRYSTAL | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1992-11-17 | — | — | US | disclosed |
| EP-0306521-B1 | ETHINE DERIVATIVES AS COMPOUNDS OF LIQUID CRYSTAL PHASES | MERCK PATENT GmbH (DE) | 1991-10-16 | — | — | EP | disclosed |