Propranolol

Propranolol

SCHEMBL6617077

CC(C)NCC(O)COc1cccc2ccccc12.O=[N+]([O-])O

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2

The experimentally established mechanism targets of Propranolol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 known ✓ P07550 7/20 0.83
▸ ADRB1 known ✓ P08588 6/20 0.83
▸ CYP2D6 P10635 6/20 0.83
▸ NR2E1 Q9Y466 5/20 0.83
▸ ADRB3 P13945 5/20 0.83
▸ SIGMAR1 Q99720 4/20 0.83
▸ CYP1A2 P05177 4/20 0.83
▸ SLC6A4 P31645 3/20 0.83
▸ HTR2B P41595 3/20 0.83
▸ ALDH1A1 P00352 3/20 0.83
▸ HTR2A P28223 3/20 0.83
▸ HTR2C P28335 3/20 0.83
▸ HTR6 P50406 3/20 0.83
▸ TSHR P16473 3/20 0.83
▸ SCN1A P35498 2/20 0.83
▸ SLC10A1 Q14973 2/20 0.83
▸ SCN2A Q99250 2/20 0.83
▸ SCN3A Q9NY46 2/20 0.83
▸ SMN1; SMN2 Q16637 2/20 0.83
▸ HTR1A P08908 2/20 0.83

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.

Compoundsimilaritytop predictedshared targets
Propranolol SCHEMBL19177401 1.00 ADRB2 (0.83) ADRB2ADRB1CYP2D6NR2E1ADRB3
Propranolol SCHEMBL19177403 1.00 ADRB2 (0.83) ADRB2ADRB1CYP2D6NR2E1ADRB3
Levopropranolol SCHEMBL29355940 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Levopropranolol SCHEMBL3956 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Dexpropranolol SCHEMBL29577201 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Propranolol SCHEMBL10537386 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Propranolol SCHEMBL1561135 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Propranolol SCHEMBL3955 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Propranolol SCHEMBL6511347 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3
Dexpropranolol SCHEMBL25255 0.91 ADRB2 (1.00) ADRB2ADRB1CYP2D6NR2E1ADRB3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1087953-B1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX SA (FR) 2004-11-17 — — EP disclosed
US-20040147575-A1 Nitrate salts of antihypertensive medicines NICOX S.A. 2004-07-29 — — US disclosed
US-6645965-B1 Sildenafil, hydralazine, minoxidil, or zaprinast; cardiovascular disorders NICOX S.A. (FR) 2003-11-11 — — US disclosed
EP-1087953-A1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX S.A. (FR) 2001-04-04 — — EP disclosed
WO-1999067231-A1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX S.A. (FR) 1999-12-29 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040147575-A1 Nitrate salts of antihypertensive medicines NOS2, NOS1, NOS3 ADRB2 90/4885ADRB1 42/4885CYP2D6 207/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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