Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | KIF11 | P52732 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11109085 | 0.97 | ABCG2 (0.56) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL10853824 | 0.91 | ABCG2 (0.55) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| Hydrochloric Acid SCHEMBL10853829 | 0.91 | ABCG2 (0.54) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL10852571 | 0.88 | ABCG2 (0.58) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL11110961 | 0.87 | ABCG2 (0.53) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL10855792 | 0.86 | ABCG2 (0.52) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL10810357 | 0.86 | ABCG2 (0.52) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL11127759 | 0.85 | ABCG2 (0.57) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL10856970 | 0.84 | KIF11 (0.54) | ABCG2ABCB1KDM4EMAPTRAB9A | |
| SCHEMBL10859605 | 0.84 | ABCG2 (0.54) | ABCG2ABCB1KDM4EMAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0101574-A1 | 2-Substituted 1-aminoalkyl-1,2,3,4-tetrahydro-beta-carbolines, their preparation and use as medicaments | BASF Aktiengesellschaft (DE) | 1984-02-29 | — | — | EP | disclosed |