Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 4/20 | 0.53 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.53 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.49 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.47 |
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 SCHEMBL6586001 | 0.99 | CHRNA3 (0.52) | CHRNA3CHRNB4CHRNB2CHRNA4AKT1 | |
| SCHEMBL7410667 | 0.91 | KDM4E (0.50) | CHRNB2CHRNA4 | |
| SCHEMBL6586751 | 0.86 | CHRNA3 (0.54) | CHRNA3CHRNB4CHRNB2CHRNA4AKT1 | |
| Hydrochloric Acid SCHEMBL8142789 | 0.85 | CHRNA3 (0.53) | CHRNA3CHRNB4CHRNB2CHRNA4AKT1 | |
| Hydrochloric Acid SCHEMBL6585643 | 0.85 | CHRNA3 (0.53) | CHRNA3CHRNB4CHRNB2CHRNA4AKT1 | |
| SCHEMBL7823760 | 0.83 | CHRNA3 (0.59) | CHRNA3CHRNB4CHRNB2CHRNA4CHRNA5 | |
| SCHEMBL7815971 | 0.83 | CHRNA3 (0.59) | CHRNA3CHRNB4CHRNB2CHRNA4CHRNA5 | |
| SCHEMBL7825114 | 0.81 | CHRNA3 (0.56) | CHRNA3CHRNB4CHRNB2CHRNA4CHRNA5 | |
| SCHEMBL7825928 | 0.81 | CHRNA3 (0.56) | CHRNA3CHRNB4CHRNB2CHRNA4CHRNA5 | |
| SCHEMBL7825495 | 0.81 | CHRNA3 (0.61) | CHRNA3CHRNB4CHRNB2CHRNA4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6127386-A | STIMULANTS, NEUROTRANSMITTERS, CHOLINERGIC AGENTS | ABBOTT LABORATORIES (US) | 2000-10-03 | — | — | US | claimed |
| 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 |
| EP-0934308-A1 | 3-PYRIDYLOXYMETHYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | Abbott Laboratories (US) | 1999-08-11 | — | — | EP | disclosed |
| WO-1997046554-A1 | 3-PYRIDYLOXYMETHYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LABORATORIES (US) | 1997-12-11 | — | — | WO | disclosed |