Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 5/20 | 0.60 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.60 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.60 |
| ▸ | CHRNB2 | P17787 | 6/20 | 0.57 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.57 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.57 |
| ▸ | CHRNB3 | Q05901 | 3/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6585211 | 0.99 | CHRNB4 (0.59) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL6585613 | 0.93 | CHRNA3 (0.55) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL6583104 | 0.92 | CHRNA3 (0.54) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7831846 | 0.86 | CHRNB4 (0.65) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL7828185 | 0.85 | CHRNB4 (0.64) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7829275 | 0.84 | CHRNB2 (0.64) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7816529 | 0.84 | CHRNB2 (0.64) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL6581677 | 0.84 | CHRNA3 (0.62) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL6584569 | 0.84 | CHRNA3 (0.62) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL6584855 | 0.83 | CHRNA3 (0.61) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 |
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-0934308-B1 | 3-PYRIDYLOXYMETHYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LAB (US) | 2004-08-11 | — | — | EP | disclosed |
| US-6437138-B1 | 5-BROMO-6-CHLORO-3-(2-(S)-AZETIDINYL OR PYRROLIDINYL-METHOXY) PYRIDINE INTERMEDIATES FOR THE 5-SUBSTITUTED COMPOUNDS WHICH ARE POTENT LIGANDS AT NEURONAL NICOTINIC CHOLINERGIC CHANNEL RECEPTORS, NEUROTRANSMITTER CONTROLLING AGENTS | ABBOTT LABORATORIES | 2002-08-20 | — | — | US | disclosed |
| US-6127386-A | STIMULANTS, NEUROTRANSMITTERS, CHOLINERGIC AGENTS | ABBOTT LABORATORIES (US) | 2000-10-03 | — | — | US | disclosed |