Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.46 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.43 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL478979 | 0.83 | KDM4E (0.53) | KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10 | |
| SCHEMBL7984819 | 0.82 | HDAC8 (0.64) | ALDH1A1SMN1; SMN2KAT6ANPC1POLB | |
| SCHEMBL7984974 | 0.82 | L3MBTL1 (0.59) | KDM4EALDH1A1SMN1; SMN2NPC1POLB | |
| Hydrochloric Acid SCHEMBL8306980 | 0.82 | KDM4E (0.51) | KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10 | |
| SCHEMBL17806411 | 0.81 | SMN1; SMN2 (0.51) | KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10 | |
| SCHEMBL29659751 | 0.81 | HDAC1 (0.62) | KDM4EALDH1A1SMN1; SMN2KAT6ALMNA | |
| SCHEMBL7983790 | 0.81 | HDAC1 (0.62) | KDM4EALDH1A1SMN1; SMN2KAT6ALMNA | |
| SCHEMBL7983817 | 0.81 | FLT1 (0.61) | ALDH1A1MEN1KMT2ACA1CA2 | |
| SCHEMBL24420690 | 0.80 | LMNA (0.51) | KDM4EALDH1A1SMN1; SMN2LMNANPC1 | |
| SCHEMBL8543957 | 0.79 | ALDH1A1 (0.49) | KDM4EALDH1A1SMN1; SMN2NPSR1HSD17B10 |
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-5360802-A | Antagonists of cholecystokinin and gastrin | MERCK SHARPE & DOHME LTD. | 1994-11-01 | — | — | US | disclosed |
| EP-0514133-A1 | Benzodiazepine derivatives, compositions containing them and their use in therapy | MERCK SHARP & DOHME LTD. (GB) | 1992-11-19 | — | — | EP | disclosed |