Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | PREP | P48147 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | PPID | Q08752 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9179794 | 0.78 | GRM2 (0.43) | KDM4ESMN1; SMN2MAPTNPC1GRIN2B | |
| Hydrochloric Acid SCHEMBL8993826 | 0.71 | ALDH1A1 (0.51) | ALDH1A1KDM4ETSHRSMN1; SMN2KMT2A | |
| SCHEMBL9478463 | 0.69 | MAPT (0.41) | POLBMAPT | |
| SCHEMBL9184025 | 0.68 | CASP3 (0.44) | ALDH1A1KDM4ESMN1; SMN2POLB | |
| SCHEMBL7444409 | 0.67 | KMT2A (0.41) | ALDH1A1KDM4ESMN1; SMN2POLBKMT2A | |
| SCHEMBL29518393 | 0.67 | LTA4H (0.57) | ALDH1A1POLBKMT2ANPC1TDP1 | |
| SCHEMBL27829698 | 0.66 | KMT2A (0.60) | ALDH1A1KDM4ESMN1; SMN2POLBKMT2A | |
| SCHEMBL14597067 | 0.66 | KCNQ2 (0.50) | ALDH1A1TSHRKMT2AMAPT | |
| SCHEMBL10381350 | 0.65 | LTA4H (0.58) | ALDH1A1KDM4EPOLBKMT2ANPC1 | |
| SCHEMBL18050010 | 0.64 | LOXL2 (0.57) | ALDH1A1KDM4ETSHRSMN1; SMN2POLB |
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-5438063-A | Hypotensive agents, cardiac insufficiency, increased intraocular pressure, and CNS disorders | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1995-08-01 | — | — | US | disclosed |
| EP-0628556-A1 | Imidazopyridines | MERCK PATENT GmbH (DE) | 1994-12-14 | — | — | EP | disclosed |