Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FOLH1 | Q04609 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | FNTA | P49354 | 1/20 | 0.45 |
| ▸ | FNTB | P49356 | 1/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | CPA1 | P15085 | 1/20 | 0.43 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8794402 | 0.94 | FOLH1 (0.43) | FOLH1KMT2AMEN1ALDH1A1L3MBTL1 | |
| SCHEMBL7749727 | 0.89 | OPRK1 (0.48) | KMT2AMEN1ALDH1A1L3MBTL1ANPEP | |
| Trifluoroacetic Acid SCHEMBL8793852 | 0.85 | OPRK1 (0.46) | KMT2AMEN1ALDH1A1L3MBTL1ANPEP | |
| SCHEMBL8439130 | 0.81 | FNTA (0.63) | FOLH1KMT2AMEN1ALDH1A1L3MBTL1 | |
| SCHEMBL7751346 | 0.81 | FNTA (0.63) | FOLH1KMT2AMEN1ALDH1A1L3MBTL1 | |
| SCHEMBL24130549 | 0.79 | PIN1 (0.55) | KMT2AMEN1ALDH1A1OPRD1MAPT | |
| SCHEMBL7788436 | 0.78 | FOLH1 (0.56) | FOLH1KMT2AMEN1ALDH1A1L3MBTL1 | |
| SCHEMBL5999001 | 0.74 | NQO2 (0.62) | KMT2AMEN1ALDH1A1ANPEPMAPT | |
| SCHEMBL8673871 | 0.73 | MME (0.63) | KMT2AMEN1TACR1MMEACE | |
| SCHEMBL2761181 | 0.73 | MME (0.63) | KMT2AMEN1TACR1MMEACE |
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 |
|---|---|---|---|---|---|---|---|
| EP-0952842-A2 | A METHOD OF TREATING CANCER | Merck & Co., Inc. (US) | 1999-11-03 | — | — | EP | claimed |
| WO-1997038664-A2 | A METHOD OF TREATING CANCER | MERCK & CO., INC. (US) | 1997-10-23 | — | — | WO | claimed |