Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 3/20 | 0.32 |
| ▸ | CES2 | O00748 | 5/20 | 0.32 |
| ▸ | CES1 | P23141 | 5/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6012107 | 0.80 | AKR1B1 (0.36) | TDP1CES2CES1MEN1KMT2A | |
| SCHEMBL7219686 | 0.77 | CA1 (0.38) | TDP1CA1CA2FAAHCES2 | |
| SCHEMBL9848101 | 0.75 | ALDH1A1 (0.39) | CES2CES1ALDH1A1 | |
| SCHEMBL537242 | 0.75 | ALDH1A1 (0.38) | CA1CA2FAAHCES2CES1 | |
| SCHEMBL6602326 | 0.74 | ALDH1A1 (0.41) | FAAHSOAT1TSHRALOX15ALDH1A1 | |
| SCHEMBL30840393 | 0.71 | TSHR (0.33) | TSHR | |
| SCHEMBL203812 | 0.71 | TSHR (0.33) | MEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL5132104 | 0.71 | CES1 (0.41) | TDP1CA1CES2CES1TP53 | |
| SCHEMBL437089 | 0.71 | TSHR (0.33) | CES1MEN1CYP3A4KMT2ATSHR | |
| Hexane SCHEMBL27990720 | 0.69 | TDP1 (0.67) | TDP1FAAHCES2CES1TP53 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0430037-A2 | Process for producing 2-carbon-substituted carbapenem derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1991-06-05 | — | — | EP | disclosed |