Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.43 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 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 | |
|---|---|---|---|---|
| SCHEMBL7530417 | 0.94 | CA12 (0.47) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL9394103 | 0.89 | LPAR1 (0.39) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL11572643 | 0.88 | CYP1A1 (0.42) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL7489674 | 0.87 | CA1 (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5901796 | 0.85 | CA12 (0.42) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL31018274 | 0.84 | CYP1A2 (0.47) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL30057750 | 0.84 | CYP1A2 (0.47) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL31018275 | 0.84 | CYP1A2 (0.47) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL2214188 | 0.84 | CYP1A2 (0.47) | CYP1A2CYP1A1CYP1B1LPAR1CA12 | |
| SCHEMBL8132623 | 0.81 | CA12 (0.50) | CYP1A2CYP1A1CYP1B1CA12CA1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0713489-B1 | PHOTOCHROMIC HETEROCYCLOCHROMENES | PILKINGTON PLC (GB) | 2000-11-02 | — | — | EP | disclosed |
| US-5623005-A | NAPTHOPYRAN COMPOUNDS CONTAINING AMINE SUBSTITUTION AT 6-POSITION; USEFUL TO MAKE OPHTHALMIC LENS | PILKINGTON PLC (GB) | 1997-04-22 | — | — | US | disclosed |
| EP-0691965-B1 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PILKINGTON PLC (GB) | 1996-12-04 | — | — | EP | disclosed |
| EP-0691965-A1 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PILKINGTON PLC (GB) | 1996-01-17 | — | — | EP | disclosed |
| WO-1994022850-A1 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PILKINGTON PLC (GB) | 1994-10-13 | — | — | WO | disclosed |