Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GRK2 | P25098 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | IGF1R | P08069 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9813451 | 0.87 | CA2 (0.51) | KMT2APOLBGRK2GAAALDH1A1 | |
| SCHEMBL10584133 | 0.83 | KMT2A (0.58) | KMT2APOLBGRK2GAAALDH1A1 | |
| SCHEMBL9320853 | 0.83 | GAA (0.62) | KMT2AGAAALDH1A1HDAC1HDAC8 | |
| SCHEMBL10580731 | 0.83 | HDAC1 (0.56) | KMT2APOLBGRK2ALDH1A1HDAC1 | |
| SCHEMBL3250400 | 0.83 | TBXA2R (0.62) | KMT2APOLBGRK2GAAALDH1A1 | |
| SCHEMBL19281469 | 0.81 | MGLL (0.55) | MGLLKMT2AGAAALDH1A1MEN1 | |
| SCHEMBL9813778 | 0.81 | ALDH1A1 (0.45) | KMT2APOLBGRK2GAAALDH1A1 | |
| SCHEMBL9813760 | 0.80 | KMT2A (0.47) | KMT2APOLBGRK2GAAALDH1A1 | |
| SCHEMBL9813846 | 0.80 | LTB4R (0.55) | KMT2APOLBGRK2GAAALDH1A1 | |
| SCHEMBL9101593 | 0.80 | ESR1 (0.59) | KMT2AGAAALDH1A1HDAC1HDAC8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991019700-A1 | PHARMACEUTICALLY ACTIVE BENZOQUINAZOLINE COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-26 | — | — | WO | disclosed |
| US-5070099-A | THROMBOXANE ANTAGONISTS | E. R. SQUIBB & SONS, INC. (US) | 1991-12-03 | — | — | US | disclosed |
| US-5006542-A | Cardiovascular agents | E. R. SQUIBB & SONS, INC. (US) | 1991-04-09 | — | — | US | disclosed |