Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | LPAR1 | Q92633 | 7/20 | 0.39 |
| ▸ | LPAR3 | Q9UBY5 | 7/20 | 0.39 |
| ▸ | LPAR2 | Q9HBW0 | 4/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | PRKCG | P05129 | 1/20 | 0.37 |
| ▸ | PRKCB | P05771 | 1/20 | 0.37 |
| ▸ | PRKCA | P17252 | 1/20 | 0.37 |
| ▸ | PRKCH | P24723 | 1/20 | 0.37 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.37 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.37 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.37 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.37 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.37 |
| ▸ | LPAR5 | Q9H1C0 | 4/20 | 0.36 |
| ▸ | LPAR6 | P43657 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6934621 | 1.00 | TDP1 (0.43) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6936740 | 1.00 | TDP1 (0.43) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL7912478 | 1.00 | TDP1 (0.43) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6939871 | 1.00 | TDP1 (0.43) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6936714 | 1.00 | TDP1 (0.43) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL7919344 | 1.00 | TDP1 (0.43) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6938894 | 0.98 | TDP1 (0.44) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6940412 | 0.97 | USP2 (0.44) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6940229 | 0.97 | USP2 (0.44) | TDP1USP2SPHK1HTTLPAR1 | |
| SCHEMBL6939669 | 0.97 | USP2 (0.44) | TDP1USP2SPHK1HTTLPAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0962445-B1 | Acetylene compound, liquid crystal composition and liquid crystal element | MITSUI CHEMICALS INC (JP) | 2003-02-26 | — | — | EP | disclosed |
| US-6217793-B1 | Acetylene compound, liquid crystal composition and liquid crystal element | MITSUI CHEMICALS, INC. (JP) | 2001-04-17 | — | — | US | disclosed |
| EP-0962445-A1 | Acetylene compound, liquid crystal composition and liquid crystal element | Mitsui Chemicals, Inc. (JP) | 1999-12-08 | — | — | EP | disclosed |