Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | MDM4 | O15151 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11566775 | 0.87 | KIF11 (0.39) | KMT2AKCNN4CES1KIF11TSHR | |
| SCHEMBL1235122 | 0.78 | KMT2A (0.48) | KMT2AKCNN4CES1KIF11CYP1A2 | |
| SCHEMBL7213724 | 0.76 | KMT2A (0.50) | KMT2AKCNN4CES1KIF11CYP1A2 | |
| SCHEMBL7208176 | 0.73 | KMT2A (0.47) | KMT2AKCNN4CES1KIF11CYP1A2 | |
| SCHEMBL27508043 | 0.73 | KMT2A (0.45) | KMT2AKCNN4CES1KIF11MDM4 | |
| SCHEMBL11231840 | 0.72 | KMT2A (0.50) | KMT2AKCNN4CES1KIF11CYP1A2 | |
| SCHEMBL1068997 | 0.72 | KMT2A (0.50) | KMT2AKCNN4CES1KIF11CYP1A2 | |
| SCHEMBL15258811 | 0.71 | KMT2A (0.46) | KMT2AKCNN4CES1KIF11CYP1A2 | |
| SCHEMBL27678470 | 0.71 | KMT2A (0.42) | KMT2AKCNN4KIF11CYP1A2TSHR | |
| SCHEMBL1526022 | 0.71 | KMT2A (0.64) | KMT2ATSHRPTGS1PTGS2MEN1 |
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-4329363-A | Substituted mercapto acid amides and their use | MERCK & CO., INC. (US) | 1982-05-11 | — | — | US | disclosed |
| US-4216160-A | IMMUNOREGULANTS FOR CORRECTING AN INBALANCE OF IMMUNE HOMEOSTASIS | MERCK & CO., INC. (US) | 1980-08-05 | — | — | US | disclosed |