Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | APP | P05067 | 3/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL422166 | 0.85 | CYP1A2 (0.67) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| Iodomethane SCHEMBL4054071 | 0.82 | CYP1A2 (0.63) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| Hydrochlorthiazide SCHEMBL9108846 | 0.82 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C19PDK1MAPT | |
| SCHEMBL9190961 | 0.79 | CYP1A2 (0.58) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| SCHEMBL2170339 | 0.76 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| SCHEMBL13862753 | 0.74 | NPC1 (0.56) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| SCHEMBL25250383 | 0.73 | TDP1 (0.55) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| SCHEMBL95067 | 0.73 | NPC1 (0.55) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| SCHEMBL31276816 | 0.73 | NPC1 (0.55) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 | |
| SCHEMBL2172527 | 0.72 | TDP1 (0.57) | CYP1A2CYP3A4CYP2C19TDP1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5114621-A | INDOLINO-SPIRO-OXAZINE PHOTOCHROMIC COMPOUNDS WITH FIVE-MEMBERED RINGS, METHOD FOR THEIR PREPARATION, PHOTOCHROMIC COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOUNDS | ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE (FR) | 1992-05-19 | — | — | US | disclosed |