Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bambuterol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.95 |
| ▸ | BCHE | P06276 | 6/20 | 0.95 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.95 |
| ▸ | ACHE | P22303 | 2/20 | 0.95 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.95 |
| ▸ | LMNA | P02545 | 1/20 | 0.95 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.95 |
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 | |
|---|---|---|---|---|
| Bambuterol SCHEMBL4432 | 0.97 | BCHE (1.00) | BCHECYP2D6ACHEADRB2KCNH2 | |
| Bambuterol SCHEMBL4431 | 0.97 | BCHE (1.00) | BCHECYP2D6ACHEADRB2KCNH2 | |
| Bambuterol SCHEMBL13923751 | 0.97 | BCHE (1.00) | BCHECYP2D6ACHEADRB2KCNH2 | |
| Bambuterol SCHEMBL744580 | 0.96 | BCHE (0.97) | BCHECYP2D6ACHEADRB2KCNH2 | |
| Bambuterol SCHEMBL3713500 | 0.94 | BCHE (0.92) | BCHECYP2D6ACHEADRB2KCNH2 | |
| SCHEMBL15790253 | 0.92 | BCHE (0.90) | BCHECYP2D6ACHEADRB2KCNH2 | |
| Bambuterol SCHEMBL21645369 | 0.92 | BCHE (0.90) | BCHECYP2D6ACHEADRB2KCNH2 | |
| SCHEMBL21674420 | 0.91 | BCHE (0.88) | BCHECYP2D6ACHEADRB2KCNH2 | |
| SCHEMBL15790471 | 0.90 | BCHE (0.85) | BCHECYP2D6ACHEADRB2KCNH2 | |
| Hydrochloric Acid SCHEMBL11123610 | 0.90 | BCHE (0.85) | BCHECYP2D6ACHEADRB2KCNH2 |
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-7927613-B2 | Pharmaceutical co-crystal compositions | UNIVERSITY OF SOUTH FLORIDA (US) | 2011-04-19 | — | — | US | disclosed |
| US-7790905-B2 | Pharmaceutical propylene glycol solvate compositions | MCNEIL-PPC, INC. (US) | 2010-09-07 | — | — | US | disclosed |