Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 3/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4958719 | 1.00 | CA2 (0.43) | CA2CYP3A4MAPK1MMEBCHE | |
| SCHEMBL4958715 | 1.00 | CA2 (0.43) | CA2CYP3A4MAPK1MMEBCHE | |
| SCHEMBL4248708 | 0.86 | CA2 (0.46) | CA2CYP3A4MAPK1BCHEBACE1 | |
| SCHEMBL4248713 | 0.86 | CA2 (0.46) | CA2CYP3A4MAPK1BCHEBACE1 | |
| SCHEMBL4959183 | 0.84 | CTRB1 (0.48) | CA2CYP3A4MAPK1 | |
| SCHEMBL4959188 | 0.84 | CTRB1 (0.48) | CA2CYP3A4MAPK1 | |
| SCHEMBL4958681 | 0.81 | CA2 (0.52) | CA2CYP3A4MAPK1BCHECCR1 | |
| SCHEMBL4958673 | 0.81 | CA2 (0.52) | CA2CYP3A4MAPK1BCHECCR1 | |
| SCHEMBL4957679 | 0.79 | CA2 (0.43) | CA2CYP3A4MMEBCHEBACE1 | |
| SCHEMBL4957683 | 0.79 | CA2 (0.43) | CA2CYP3A4MMEBCHEBACE1 |
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-2081917-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | Abbott Laboratories (US) | 2009-07-29 | — | — | EP | disclosed |
| WO-2008027932-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | ABBOTT LABORATORIES (US) | 2008-03-06 | — | — | WO | disclosed |