Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.50 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.49 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.47 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.47 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.47 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.47 |
| ▸ | VNN1 | O95497 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL4475347 | 0.92 | NPC1 (0.60) | NPC1RAB9AEPHX2TRPV1VNN1 | |
| Hydrochloric Acid SCHEMBL3539826 | 0.90 | NPC1 (0.58) | NPC1RAB9AEPHX2TRPV1VNN1 | |
| SCHEMBL5541822 | 0.85 | ESR1 (0.58) | NPC1RAB9AEPHX2TRPV1VNN1 | |
| SCHEMBL4602009 | 0.85 | ELANE (0.56) | NPC1RAB9AEPHX2GAAFAAH | |
| SCHEMBL22721360 | 0.85 | EPHX2 (0.62) | NPC1RAB9AEPHX2TRPV1FAAH | |
| SCHEMBL255560 | 0.83 | GPR3 (0.52) | HSD11B1EPHX2GAA | |
| SCHEMBL11059240 | 0.83 | TRPV1 (0.69) | NPC1RAB9AEPHX2TRPV1 | |
| SCHEMBL22740915 | 0.83 | PARP10 (0.53) | NPC1RAB9AEPHX2TRPV1VNN1 | |
| SCHEMBL3833768 | 0.83 | PPARA (0.63) | NPC1RAB9AEPHX2TRPV1 | |
| SCHEMBL21900516 | 0.83 | ELANE (0.51) | NPC1RAB9ALTA4HABCC9ABCC8 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6242654-B1 | REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND | MITSUI CHEMICALS, INC. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-1013629-A1 | Preparation process of fluorine subsituted aromatic compound | Mitsui Chemicals, Inc. (JP) | 2000-06-28 | — | — | EP | disclosed |
| US-4446078-A | REACTING A POLYHALOALKOXY- OR POLYHALOALKYLTHIOBENZENE WITH A CARBOXYLIC DERIVATIVE, BORON TRIFLUORIDE | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-05-01 | — | — | US | disclosed |
| US-4438043-A | Process for preparation of di- or trifluoromethoxyphenyl ketones or di- or trifluoromethylthiophenyl ketones | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-03-20 | — | — | US | disclosed |