Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8195063 | 0.88 | CA12 (0.55) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL10687263 | 0.81 | MAPT (0.51) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2308812 | 0.78 | HSD17B2 (0.62) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL8195783 | 0.77 | CA12 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8192970 | 0.77 | HSD17B2 (0.64) | HSD17B2CA12CA1CA2CA7 | |
| Ethyltrimethoxy Benzoate SCHEMBL4410910 | 0.76 | KMT2A (0.66) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL582920 | 0.76 | HSD17B2 (0.68) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL18969570 | 0.75 | KDM4E (0.45) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29850871 | 0.75 | KDM4E (0.45) | CA12CA1CA2CA7CA9 | |
| SCHEMBL1458301 | 0.74 | HSD17B2 (0.61) | HSD17B2CA12CA1CA2CA7 |
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-6165980-A | Distamycin derivatives, process for preparing them, and their use as antitumor and antiviral agents | PHARMACIA & UPJOHN S.P.A. (IT) | 2000-12-26 | — | — | US | disclosed |