Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
| ▸ | ALPI | P09923 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | CPA3 | P15088 | 3/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | CPA1 | P15085 | 2/20 | 0.35 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.35 |
| ▸ | CPB1 | P15086 | 1/20 | 0.35 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.35 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.35 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL4591556 | 0.81 | CYP1A2 (0.38) | CYP1A2MMEALPIPKMPTGS1 | |
| SCHEMBL4623911 | 0.77 | AKR1C3 (0.42) | CYP1A2CAPN1KMT2A | |
| SCHEMBL4450793 | 0.68 | SLC6A2 (0.44) | CYP1A2EPHX1TAAR1 | |
| SCHEMBL7197326 | 0.67 | CAPN1 (0.44) | CYP1A2ALPIPKMPTGS1XIAP | |
| SCHEMBL12556390 | 0.66 | HSD17B10 (0.45) | PTGS1FOLH1MEN1KMT2A | |
| SCHEMBL3961925 | 0.65 | CYP1A2 (0.55) | CYP1A2MMEALPIPKMPTGS1 | |
| Phenylacetic Acid SCHEMBL28089878 | 0.65 | AKR1B1 (0.68) | PTGS1MEN1KMT2A | |
| SCHEMBL2928010 | 0.65 | CYP1A2 (0.55) | CYP1A2MMEALPIPKMPTGS1 | |
| SCHEMBL9287878 | 0.65 | POLB (0.44) | CYP1A2ALPIPKMPTGS1XIAP | |
| SCHEMBL6132238 | 0.65 | ACE2 (0.36) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2404962-B1 | Softener preparations with good gelling characteristics | LANXESS DEUTSCHLAND GMBH (DE) | 2013-01-16 | — | — | EP | disclosed |
| EP-2404962-A1 | Softener preparations with good gelling characteristics | LANXESS Deutschland GmbH (DE) | 2012-01-11 | — | — | EP | disclosed |