Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL806323 | 0.88 | CYP1A2 (0.68) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL27919196 | 0.86 | CYP1A2 (0.65) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL8153220 | 0.86 | CYP2A6 (0.70) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL607927 | 0.85 | CYP1A2 (0.71) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL27937804 | 0.84 | CYP2A6 (0.67) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL12017095 | 0.84 | CYP2A6 (0.62) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL12405217 | 0.83 | CYP1A2 (0.55) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL12260024 | 0.83 | CYP1A2 (0.55) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL597341 | 0.83 | CYP1A2 (0.67) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL12277510 | 0.83 | CYP1A2 (0.55) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6495220-B2 | WITH POSITIVE DIELECTRIC ANISOTROPY AND FAVORABLE VISCOSITY; THERMAL, LIGHT AND ULTRAVIOLET STABILITY; USE IN PORTABLE TELEPHONES AND NOTEBOOK COMPUTERS | CLARIANT INTERNATIONAL LTD. (CH) | 2002-12-17 | — | — | US | disclosed |
| US-20010023935-A1 | With positive dielectric anisotropy and favorable viscosity; thermal, light and ultraviolet stability; use in portable telephones and notebook computers | CLARIANT INTERNATIONAL LTD. (CH) | 2001-09-27 | — | — | US | disclosed |