Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.36 |
| ▸ | CACNB2 | Q08289 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9547906 | 0.85 | ALDH1A1 (0.50) | ALDH1A1TSHRHSD17B10ALOX15MEN1 | |
| SCHEMBL9133521 | 0.81 | ALDH1A1 (0.44) | ALDH1A1TSHRMEN1KMT2AGAA | |
| SCHEMBL2800138 | 0.78 | ALOX5 (0.40) | ALDH1A1KMT2AATMPOLBFFAR1 | |
| SCHEMBL2799259 | 0.77 | CACNA2D1 (0.56) | ALDH1A1TSHRHSD17B10ALOX15MEN1 | |
| SCHEMBL8013623 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10MEN1KMT2A | |
| SCHEMBL14677386 | 0.76 | CACNA2D1 (0.39) | ALDH1A1HSD17B10MEN1KMT2AGAA | |
| SCHEMBL2197891 | 0.75 | ALOX5 (0.46) | KDM4ECACNA2D1CACNB2CACNA1C | |
| SCHEMBL9131675 | 0.75 | CHRM5 (0.47) | ALDH1A1TSHRHSD17B10ALOX15MEN1 | |
| SCHEMBL6971747 | 0.73 | ALDH1A1 (0.46) | ALDH1A1TSHRHSD17B10ALOX15MEN1 | |
| SCHEMBL1578958 | 0.73 | TSHR (0.54) | ALDH1A1TSHRHSD17B10ALOX15MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0476645-B1 | Calcium uptake inhibitors | MERRELL DOW PHARMA (US) | 1995-09-06 | — | — | EP | disclosed |
| US-5409942-A | Administering 1-phenyl-3-aryl-2-propyne-1-ones compounds | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-04-25 | — | — | US | disclosed |
| US-5223518-A | Controlling intake in leukocytes and platelets | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-06-29 | — | — | US | disclosed |
| EP-0476645-A1 | Calcium uptake inhibitors | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-03-25 | — | — | EP | disclosed |