Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.33 |
| ▸ | FNTA | P49354 | 1/20 | 0.33 |
| ▸ | FNTB | P49356 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PER2 | O15055 | 1/20 | 0.32 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.32 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL10851137 | 0.89 | HTR5A (0.40) | ABCB1ABCG2SLC6A4HTR5AHDAC6 | |
| SCHEMBL11113912 | 0.87 | EGFR (0.41) | ABCB1ABCG2SLC6A4HTR5AMTNR1B | |
| SCHEMBL10854756 | 0.86 | ABCB1 (0.40) | ABCB1ABCG2SLC6A4MTNR1BKDM4E | |
| SCHEMBL10804195 | 0.86 | ABCB1 (0.38) | ABCB1ABCG2SLC6A4HTR5AHDAC6 | |
| SCHEMBL10804503 | 0.86 | ABCB1 (0.40) | ABCB1ABCG2SLC6A4HTR5AHDAC6 | |
| SCHEMBL11112201 | 0.86 | HTR5A (0.39) | ABCB1ABCG2SLC6A4HTR5AHDAC6 | |
| Hydrochloric Acid SCHEMBL10851788 | 0.85 | ABCB1 (0.37) | ABCB1ABCG2SLC6A4HTR5AHDAC6 | |
| SCHEMBL10818546 | 0.85 | ABCB1 (0.38) | ABCB1ABCG2SLC6A4HTR5AMTNR1B | |
| SCHEMBL10808165 | 0.84 | TP53 (0.39) | ABCB1ABCG2SLC6A4HTR5AHDAC6 | |
| SCHEMBL10851703 | 0.84 | ABCB1 (0.41) | ABCB1ABCG2SLC6A4HTR5AHDAC6 |
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-4575508-A | 2-Substituted 1-(3'-aminoalkyl)-1,2,3,4-tetrahydro-β-carbolines, and their use as antiarrhythmic agents | BASF AKTIENGESELLSCHAFT (DE) | 1986-03-11 | — | — | US | disclosed |