Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | LAP3 | P28838 | 3/20 | 0.36 |
| ▸ | CPA1 | P15085 | 2/20 | 0.36 |
| ▸ | CPA3 | P15088 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7435963 | 0.82 | CYP1A2 (0.42) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL2113933 | 0.79 | EPHX1 (0.44) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL1848616 | 0.78 | EPHX1 (0.42) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL15479086 | 0.78 | CYP1A2 (0.42) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL3840796 | 0.76 | CYP1A2 (0.41) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL21056125 | 0.76 | SLC6A2 (0.48) | CYP1A2PKMSLC6A2TAAR1SLC6A4 | |
| SCHEMBL2729032 | 0.76 | SLC6A2 (0.48) | CYP1A2PKMSLC6A2TAAR1SLC6A4 | |
| SCHEMBL28997356 | 0.76 | CYP1A2 (0.41) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL27515553 | 0.76 | SLC6A2 (0.48) | CYP1A2PKMSLC6A2TAAR1SLC6A4 | |
| SCHEMBL8837437 | 0.76 | CYP1A2 (0.41) | CYP1A2EPHX1ALPIPKMPTGS1 |
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-1180115-A1 | MINIMAL ISOLATION PEPTIDE SYNTHESIS PROCESS USING ION-EXCHANGE RESINS AS SCAVENGING AGENTS | ABBOTT LABORATORIES (US) | 2002-02-20 | — | — | EP | disclosed |
| WO-2000071569-A1 | MINIMAL ISOLATION PEPTIDE SYNTHESIS PROCESS USING ION-EXCHANGE RESINS AS SCAVENGING AGENTS | ABBOTT LABORATORIES (US) | 2000-11-30 | — | — | WO | disclosed |
| EP-0216539-A2 | Novel amino acid derivatives | Kissei Pharmaceutical Co. Ltd. (JP) | 1987-04-01 | — | — | EP | disclosed |