Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6748126 | 0.76 | CYP1A2 (0.47) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| SCHEMBL21178001 | 0.76 | CA1 (0.41) | CA1CA2CA9TAAR1MEN1 | |
| SCHEMBL1826440 | 0.74 | CYP1A2 (0.51) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| SCHEMBL25610981 | 0.71 | CYP1A2 (0.49) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| SCHEMBL8907005 | 0.71 | CYP1A2 (0.49) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| SCHEMBL2608874 | 0.71 | ALDH1A1 (0.53) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| SCHEMBL30201139 | 0.71 | CYP1A2 (0.61) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| SCHEMBL574013 | 0.71 | CYP1A2 (0.61) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| Metyridine SCHEMBL30481621 | 0.71 | HRH1 (0.55) | ALDH1A1CYP1A2CYP2C19CA12CA1 | |
| Metyridine SCHEMBL167318 | 0.71 | HRH1 (0.55) | ALDH1A1CYP1A2CYP2C19CA12CA1 |
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-1583766-B1 | PROCESS FOR PREPARING PHOSPHORODIAMIDITES | RHODIA CONS SPEC LTD (GB) | 2008-08-13 | — | — | EP | disclosed |