Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | POLB | P06746 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL10986888 | 0.88 | POLB (0.55) | ALDH1A1KMT2AMEN1POLBMAPT | |
| SCHEMBL10991908 | 0.87 | RAB9A (0.56) | ALDH1A1KMT2AMEN1POLBMAPT | |
| SCHEMBL10991994 | 0.87 | POLB (0.47) | ALDH1A1KMT2ATSHRMEN1POLB | |
| SCHEMBL7441217 | 0.87 | ALDH1A1 (0.56) | ALDH1A1KMT2ATSHRMEN1POLB | |
| SCHEMBL10986641 | 0.87 | POLB (0.54) | ALDH1A1KMT2ATSHRMEN1POLB | |
| SCHEMBL10991244 | 0.87 | POLB (0.54) | ALDH1A1TSHRPOLBMAPTRAB9A | |
| SCHEMBL10997355 | 0.86 | POLB (0.55) | ALDH1A1KMT2ATSHRMEN1POLB | |
| SCHEMBL10990973 | 0.85 | KMT2A (0.57) | ALDH1A1KMT2ATSHRMEN1POLB | |
| SCHEMBL10995111 | 0.85 | LMNA (0.50) | ALDH1A1KMT2ATSHRMEN1POLB | |
| SCHEMBL10994580 | 0.84 | POLB (0.52) | ALDH1A1KMT2ATSHRPOLBMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | claimed |
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |