Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL10989692 | 0.88 | ALDH1A1 (0.56) | KMT2AMEN1ALDH1A1KDM4ENPC1 | |
| SCHEMBL10994673 | 0.88 | KMT2A (0.55) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL10991908 | 0.86 | RAB9A (0.56) | KMT2AMEN1ALDH1A1LMNANPC1 | |
| SCHEMBL10994397 | 0.85 | ALDH1A1 (0.58) | KMT2AMEN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL10986888 | 0.85 | POLB (0.55) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL10991994 | 0.83 | POLB (0.47) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL10991244 | 0.83 | POLB (0.54) | ALDH1A1LMNATSHRUSP2POLB | |
| SCHEMBL10986641 | 0.83 | POLB (0.54) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL11000010 | 0.83 | POLB (0.52) | KMT2AMEN1ALDH1A1LMNATP53 | |
| SCHEMBL10997355 | 0.83 | POLB (0.55) | KMT2AMEN1ALDH1A1LMNASMN1; 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-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |