Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | RAB9A | P51151 | 7/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.62 |
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | MAPT | P10636 | 7/20 | 0.60 |
| ▸ | MEN1 | O00255 | 5/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.50 |
| ▸ | FGB | P02675 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9192951 | 0.82 | ALDH1A1 (0.57) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL7430478 | 0.81 | NPC1 (0.54) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL9512713 | 0.81 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL3276062 | 0.81 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL14379281 | 0.80 | MAPT (0.51) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL155146 | 0.79 | ALDH1A1 (0.69) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL2298153 | 0.78 | MAPT (0.69) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL11318929 | 0.78 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL27987835 | 0.78 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL28089412 | 0.78 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRRAB9ASMN1; SMN2 |
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-4076735-A | Process for the manufacture of aminoanthraquinones | CIBA-GEIGY AG (CH) | 1978-02-28 | — | — | US | disclosed |