Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7434823 | 0.80 | AR (0.37) | HPGDALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL7434686 | 0.80 | NPC1 (0.42) | HPGDALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL7427958 | 0.80 | TSHR (0.47) | HPGDMAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL7437379 | 0.76 | MAOA (0.35) | HPGDALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL7440246 | 0.74 | HPGD (0.44) | HPGDALDH1A1KDM4EKMT2ATHRB | |
| SCHEMBL7446273 | 0.73 | HPGD (0.44) | HPGDALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL7437345 | 0.72 | RAB9A (0.50) | HPGDALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14501846 | 0.72 | LMNA (0.44) | HPGDALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL14501849 | 0.72 | LMNA (0.44) | HPGDALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL10993172 | 0.70 | ALDH1A1 (0.36) | ALDH1A1KDM4ENPC1RAB9ATHRB |
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 | disclosed |
| US-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |