Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | XIAP | P98170 | 1/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2928010 | 0.77 | CYP1A2 (0.55) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL3961925 | 0.77 | CYP1A2 (0.55) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Hydrochloric Acid SCHEMBL9514047 | 0.76 | CYP1A2 (0.53) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL9514042 | 0.74 | CYP1A2 (0.47) | EPHX1ALPIPKMPTGS1XIAP | |
| SCHEMBL27814583 | 0.74 | CTRB1 (0.51) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL27418403 | 0.74 | CYP1A2 (0.47) | EPHX1ALPIPKMPTGS1XIAP | |
| SCHEMBL6685192 | 0.74 | CYP1A2 (0.56) | EPHX1IDO1NOS1NOS3NOS2 | |
| SCHEMBL6831332 | 0.74 | EPHX1 (0.50) | EPHX1IDO1NOS1NOS3NOS2 | |
| SCHEMBL11088938 | 0.73 | MDM2 (0.59) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL6845371 | 0.73 | CYP1A2 (0.46) | EPHX1ALPIPKMPTGS1XIAP |
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-1250315-A1 | FUNCTIONAL MONOMERS FOR MOLECULAR RECOGNITION AND CATALYSIS | MIP Technologies AB (SE) | 2002-10-23 | — | — | EP | disclosed |
| WO-2001055095-A1 | FUNCTIONAL MONOMERS FOR MOLECULAR RECOGNITION AND CATALYSIS | MIP TECHNOLOGIES AB (SE) | 2001-08-02 | — | — | WO | disclosed |