Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPM1A | P35813 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | HNF4A | P41235 | 1/20 | 0.43 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | GPR3 | P46089 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27902298 | 0.84 | CYP2A6 (0.65) | CYP1A2CYP2A6RAD52KDM4EMEN1 | |
| SCHEMBL7657283 | 0.84 | GPR3 (0.53) | PPM1ACYP1A2CYP2A6KDM4EKIF11 | |
| SCHEMBL12277498 | 0.82 | CYP2A6 (0.62) | CYP1A2CYP2A6RAD52KDM4EMEN1 | |
| SCHEMBL3137389 | 0.82 | CYP2A6 (0.62) | CYP1A2CYP2A6RAD52KDM4EMEN1 | |
| SCHEMBL12259995 | 0.82 | CYP2A6 (0.62) | CYP1A2CYP2A6RAD52KDM4EMEN1 | |
| SCHEMBL7659214 | 0.81 | CYP1A2 (0.47) | PPM1ACYP1A2CYP2A6KDM4EKMT2A | |
| SCHEMBL7658885 | 0.81 | L3MBTL1 (0.47) | PPM1ACYP1A2MEN1MAPTKMT2A | |
| SCHEMBL7668224 | 0.80 | L3MBTL1 (0.47) | CYP1A2CYP2A6RAD52KDM4EMEN1 | |
| SCHEMBL12268988 | 0.80 | CYP2A6 (0.60) | CYP1A2CYP2A6RAD52KDM4EMEN1 | |
| SCHEMBL7659967 | 0.78 | CA12 (0.43) | PPM1AKIF11 |
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 |