Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 6/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9510162 | 0.99 | ACACB (0.43) | ACACBSPHK1RAB9ACYP2C9MAPT | |
| SCHEMBL9512273 | 0.95 | ACACB (0.44) | ACACBRAB9ACYP2C9MAPTALDH1A1 | |
| SCHEMBL26347314 | 0.95 | ACACB (0.44) | ACACBRAB9ACYP2C9MAPTALDH1A1 | |
| SCHEMBL9511338 | 0.94 | RAB9A (0.46) | ACACBSPHK1RAB9ACYP2C9S1PR3 | |
| SCHEMBL9508812 | 0.92 | RAB9A (0.45) | ACACBSPHK1RAB9ACYP2C9S1PR3 | |
| SCHEMBL9512219 | 0.92 | RAB9A (0.47) | ACACBRAB9ACYP2C9S1PR3LMNA | |
| SCHEMBL9743341 | 0.92 | ACACB (0.38) | ACACBSPHK1RAB9ACYP2C9S1PR3 | |
| SCHEMBL9743332 | 0.92 | ACACB (0.38) | ACACBSPHK1RAB9ACYP2C9S1PR3 | |
| SCHEMBL9744888 | 0.92 | ACACB (0.38) | ACACBSPHK1RAB9ACYP2C9S1PR3 | |
| SCHEMBL9747187 | 0.92 | ACACB (0.38) | ACACBSPHK1RAB9ACYP2C9S1PR3 |
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 |