Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | RGS12 | O14924 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8670888 | 0.88 | CA12 (0.49) | ALDH1A1KDM4EHSD17B10MAPK1L3MBTL1 | |
| SCHEMBL8667540 | 0.79 | CA12 (0.39) | ALDH1A1KDM4EHSD17B10MAPK1MEN1 | |
| SCHEMBL8666189 | 0.78 | ALDH1A1 (0.36) | ALDH1A1KDM4EHSD17B10MAPK1L3MBTL1 | |
| SCHEMBL8670248 | 0.77 | L3MBTL1 (0.44) | ALDH1A1HSD17B10L3MBTL1MEN1KMT2A | |
| SCHEMBL8047906 | 0.76 | CA9 (0.49) | ALDH1A1L3MBTL1CA12CA9RAB9A | |
| SCHEMBL8667687 | 0.73 | ADRA1D (0.70) | ADRA1DADRA1AADRA1B | |
| SCHEMBL8667580 | 0.72 | ADRA1D (0.63) | ADRA1DADRA1AADRA1B | |
| SCHEMBL8667641 | 0.69 | ADRA1D (0.39) | ALDH1A1MEN1KMT2AMAPTCA12 | |
| SCHEMBL8669865 | 0.68 | CA9 (0.52) | ALDH1A1CA12CA9HDAC1HDAC2 | |
| Dimethylamine SCHEMBL10913044 | 0.68 | ALDH1A1 (0.56) | ALDH1A1KDM4EHSD17B10MAPK1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5760054-A | BENIGN PROSTATIC HYPERTROPHY | MERCK & CO., INC. (US) | 1998-06-02 | — | — | US | disclosed |
| EP-0755392-A4 | ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1997-05-02 | — | — | EP | disclosed |
| EP-0755392-A1 | ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO. INC. (US) | 1997-01-29 | — | — | EP | disclosed |
| WO-1995028397-A1 | ALPHA1C ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1995-10-26 | — | — | WO | disclosed |