Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 12/20 | 0.67 |
| ▸ | CYP11B2 | P19099 | 12/20 | 0.67 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | FNTA | P49354 | 4/20 | 0.53 |
| ▸ | FNTB | P49356 | 4/20 | 0.53 |
| ▸ | PGGT1B | P53609 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2786255 | 0.97 | CYP11B1 (0.71) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Hydrochloric Acid SCHEMBL8481395 | 0.96 | CYP11B1 (0.69) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Bromide SCHEMBL7927507 | 0.96 | CYP11B1 (0.69) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Lithium Ion SCHEMBL8437833 | 0.87 | CYP11B1 (0.67) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL7933804 | 0.86 | CYP11B1 (0.58) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL7478451 | 0.86 | CYP11B1 (0.69) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Hydrochloric Acid SCHEMBL7802265 | 0.85 | CYP11B1 (0.67) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL8392032 | 0.85 | CYP11B1 (0.53) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Hydrochloric Acid SCHEMBL7473105 | 0.85 | CYP11B1 (0.67) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Hydrochloric Acid SCHEMBL8191731 | 0.84 | CYP11B1 (0.73) | CYP11B1CYP11B2CYP19A1FNTAFNTB |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0944388-A4 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 2001-08-16 | — | — | EP | disclosed |
| US-6248756-B1 | Inhibitors of farnesyl-protein transferase | MERCK & CO., INC. | 2001-06-19 | — | — | US | disclosed |
| EP-0944388-A2 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 1999-09-29 | — | — | EP | disclosed |
| US-5891889-A | Inhibitors of farnesyl-protein transferase | MERCK & CO., INC. (US) | 1999-04-06 | — | — | US | disclosed |
| WO-1997038665-A2 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1997-10-23 | — | — | WO | disclosed |