Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.72 |
| ▸ | CA12 | O43570 | 1/20 | 0.64 |
| ▸ | CA1 | P00915 | 1/20 | 0.64 |
| ▸ | CA2 | P00918 | 1/20 | 0.64 |
| ▸ | CA7 | P43166 | 1/20 | 0.64 |
| ▸ | CA9 | Q16790 | 1/20 | 0.64 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | SCD | O00767 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | CSF1R | P07333 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3242108 | 0.85 | CYP3A4 (0.67) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL778719 | 0.84 | CYP3A4 (0.71) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL11414056 | 0.84 | CYP3A4 (1.00) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL3235197 | 0.84 | CYP3A4 (0.71) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL27594904 | 0.82 | CYP3A4 (0.64) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL492622 | 0.81 | CYP3A4 (0.66) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL16150510 | 0.81 | CA2 (0.66) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL24133664 | 0.79 | CYP3A4 (0.70) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL10473859 | 0.79 | CA2 (1.00) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL19783432 | 0.78 | KMT2A (0.69) | CYP3A4CA12CA1CA2CA7 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2981527-B1 | DERIVATIVES OF LUCIFERIN. | UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) | 2018-10-31 | — | — | EP | disclosed |
| EP-2981527-A1 | DERIVATIVES OF LUCIFERIN | UCL Business Plc. (GB) | 2016-02-10 | — | — | EP | disclosed |
| WO-2014162157-A1 | DERIVATIVES OF LUCIFERIN | UCL BUSINESS PLC (GB) | 2014-10-09 | — | — | WO | disclosed |
| WO-2014162157-A1 | DERIVATIVES OF LUCIFERIN | UCL BUSINESS PLC (GB) | 2014-10-09 | — | — | WO | disclosed |