Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA6 | P23280 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | TPMT | P51580 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4367720 | 1.00 | SMPD1 (0.52) | SMPD1CA12CA1CA2CA4 | |
| SCHEMBL6131985 | 0.92 | CA12 (0.57) | SMPD1CA12CA1CA2CA4 | |
| SCHEMBL1331949 | 0.89 | CA12 (0.51) | SMPD1CA12CA1CA2CA4 | |
| SCHEMBL1331951 | 0.89 | CA12 (0.51) | SMPD1CA12CA1CA2CA4 | |
| SCHEMBL1011068 | 0.86 | SMN1; SMN2 (0.54) | SMPD1CA12CA1CA2CA4 | |
| SCHEMBL3267872 | 0.85 | NPC1 (0.44) | HPGDTSHRCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL3267871 | 0.85 | NPC1 (0.44) | HPGDTSHRCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8511383 | 0.85 | ALDH1A1 (0.57) | CA12CA1CA2CA4CA6 | |
| SCHEMBL8511385 | 0.85 | ALDH1A1 (0.57) | CA12CA1CA2CA4CA6 | |
| SCHEMBL3961238 | 0.84 | MAPT (0.49) | CA12CA1CA2CA4CA6 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105038760-A | Ophthalmic devices comprising photochromic materials having extended pi-conjugated systems | JOHNSON & JOHNSON VISION CARE | 2015-11-11 | — | — | CN | disclosed |
| CN-101203582-B | Ophthalmic devices comprising photochromic materials with extended pi-conjugated systems | JOHNSON & JOHNSON VISION CARE, INC. (US) | 2015-08-19 | — | — | CN | disclosed |
| CN-104130768-A | Ophthalmic devices comprising photochromic materials having extended pi-conjugated systems | JOHNSON & JOHNSON VISION CARE | 2014-11-05 | — | — | CN | disclosed |
| US-7481955-B2 | Photochromic materials comprising metallocenyl groups | TRANSITIONS OPTICAL, INC. (US) | 2009-01-27 | — | — | US | disclosed |
| US-20070278460-A1 | Photochromic materials comprising metallocenyl groups | TRANSITIONS OPTICAL LIMITED (IE) | 2007-12-06 | — | — | US | disclosed |
| WO-2007140058-A1 | PHOTOCHROMIC MATERIALS COMPRISING METALLOCENYL GROUPS | TRANSITIONS OPTICAL, INC. (US) | 2007-12-06 | — | — | WO | disclosed |