Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 SCHEMBL8355560 | 0.85 | OPRM1 (0.55) | OPRM1SLC22A1SLC6A4ADRA1AOPRD1 | |
| SCHEMBL8638671 | 0.76 | KMT2A (0.41) | ALDH1A1LMNAOPRM1OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL8355527 | 0.74 | HSD11B1 (0.48) | ALDH1A1LMNAOPRM1SLC22A1SLC6A4 | |
| SCHEMBL18390235 | 0.74 | HSD11B1 (0.53) | ALDH1A1LMNASMN1; SMN2ITGA4ITGB7 | |
| SCHEMBL27953257 | 0.73 | ITGA4 (0.48) | ALDH1A1LMNAOPRM1SLC22A1SLC6A4 | |
| Hydrochloric Acid SCHEMBL8349943 | 0.73 | HSD11B1 (0.49) | ALDH1A1LMNAOPRM1SLC22A1SLC6A4 | |
| Hydrochloric Acid SCHEMBL8353770 | 0.71 | KMT2A (0.48) | ALDH1A1LMNAOPRM1SLC22A1SLC6A4 | |
| SCHEMBL23647599 | 0.71 | ALDH1A1 (0.52) | ALDH1A1LMNAOPRM1SMN1; SMN2ITGA4 | |
| SCHEMBL8351248 | 0.70 | GPR119 (0.52) | ALDH1A1LMNAOPRD1OPRK1 | |
| SCHEMBL7010865 | 0.69 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2ITGA4ITGB7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5824690-A | TREATING ASTHMA, COUGH | HOECHST MARION ROUSSEL INC. (US) | 1998-10-20 | — | — | US | disclosed |