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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Methylene Chloride SCHEMBL27751023 | 0.87 | ALDH1A1 (0.30) | ALDH1A1TP53TSHR | |
| Acetone SCHEMBL28048045 | 0.87 | ALDH1A1 (0.30) | ALDH1A1TP53TSHR | |
| SCHEMBL6893027 | 0.83 | — | — | |
| SCHEMBL14216993 | 0.74 | — | — | |
| SCHEMBL22220175 | 0.70 | — | — | |
| SCHEMBL3822372 | 0.70 | — | — | |
| SCHEMBL28862620 | 0.68 | ALDH1A1 (0.32) | ALDH1A1TP53TSHR | |
| SCHEMBL12329853 | 0.67 | — | — | |
| SCHEMBL974183 | 0.67 | — | — | |
| SCHEMBL27274500 | 0.67 | — | — |
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-0741702-A4 | PROCESS FOR PREPARING 2-OXINDOLE-1-CARBOXAMIDES | CATALYTICA INC (US) | 1997-12-03 | — | — | EP | disclosed |
| EP-0741702-A1 | PROCESS FOR PREPARING 2-OXINDOLE-1-CARBOXAMIDES | CATALYTICA, INC. (US) | 1996-11-13 | — | — | EP | disclosed |
| US-5468873-A | Process for preparing amide n-carbox-amides | CATALYTICA, INC. (US) | 1995-11-21 | — | — | US | disclosed |
| US-5449788-A | Alcoholysis of N-acyl 2-oxoindole-1-carboxamide in Lewis acid catalyst presence | CATALYTICA, INC. (US) | 1995-09-12 | — | — | US | disclosed |
| WO-1995020574-A1 | PROCESS FOR PREPARING 2-OXINDOLE-1-CARBOXAMIDES | CATALYTICA, INC. (US) | 1995-08-03 | — | — | WO | disclosed |