Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.78 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.78 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.78 |
| ▸ | SLC16A3 | O15427 | 7/20 | 0.69 |
| ▸ | SLC16A1 | P53985 | 7/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.68 |
| ▸ | PKM | P14618 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8649661 | 1.00 | CYP1A2 (0.78) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL15428904 | 0.89 | KDM4E (0.68) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL23605194 | 0.87 | EGFR (0.60) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL9658963 | 0.86 | PKM (0.68) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL3020683 | 0.86 | CYP1A2 (0.58) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL17831051 | 0.86 | KDM4E (0.68) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL3020681 | 0.86 | CYP1A2 (0.58) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL9658958 | 0.86 | PKM (0.68) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL22635883 | 0.84 | KDM4E (0.66) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 | |
| SCHEMBL22635882 | 0.84 | KDM4E (0.66) | CYP1A2CYP3A4CYP2C9SLC16A3SLC16A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0335641-B1 | Organic nonlinear optical substance | TEIJIN LTD (JP) | 1994-01-05 | — | — | EP | disclosed |
| US-5196147-A | Optical crystals | TEIJIN LIMITED (JP) | 1993-03-23 | — | — | US | disclosed |
| EP-0335641-A2 | Organic nonlinear optical substance | TEIJIN LIMITED (JP) | 1989-10-04 | — | — | EP | disclosed |