Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11922708 | 0.74 | KMT2A (0.59) | KMT2AHDAC8HDAC6CYP2D6MEN1 | |
| SCHEMBL4752721 | 0.71 | POLB (0.56) | KMT2AHDAC8HDAC6CYP2D6NPC1 | |
| SCHEMBL20179589 | 0.70 | POLB (0.53) | KMT2AMEN1POLBSMN1; SMN2KDM4E | |
| SCHEMBL21789041 | 0.70 | POLB (0.51) | KMT2AHDAC8HDAC6CYP2D6NPC1 | |
| SCHEMBL21789275 | 0.70 | CYP2D6 (0.60) | KMT2ACYP2D6NPC1MEN1POLB | |
| SCHEMBL3451518 | 0.69 | KMT2A (0.48) | KMT2AHDAC8HDAC6CYP2D6NPC1 | |
| SCHEMBL2716888 | 0.68 | MAOB (0.63) | KMT2ACYP2D6MEN1POLBSMN1; SMN2 | |
| SCHEMBL8486025 | 0.68 | CTSK (0.51) | KMT2ACYP2D6NPC1CTSKMEN1 | |
| SCHEMBL2719543 | 0.67 | — | — | |
| SCHEMBL11766770 | 0.67 | MAOB (0.66) | KMT2ACYP2D6MEN1POLBSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018093695-A1 | FACTOR XIIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |