Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F13A1 | P00488 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL28629668 | 0.83 | F13A1 (0.46) | F13A1KDM4ETDP1HDAC3MAPK1 | |
| SCHEMBL27491210 | 0.81 | PTGDR2 (0.42) | KDM4EPTGDR2MEN1KMT2ALMNA | |
| SCHEMBL19584858 | 0.80 | NPC1 (0.45) | F13A1KDM4ETDP1HDAC3MAPK1 | |
| SCHEMBL15270886 | 0.79 | POLB (0.49) | F13A1KDM4ETDP1HDAC3MAPK1 | |
| SCHEMBL3858358 | 0.78 | NPSR1 (0.52) | F13A1KDM4ETDP1HDAC3MAPK1 | |
| SCHEMBL2818682 | 0.78 | PDPK1 (0.56) | F13A1KDM4ETDP1FFAR4 | |
| SCHEMBL30917833 | 0.78 | F13A1 (0.44) | F13A1KDM4ETDP1HDAC3MAPK1 | |
| SCHEMBL28066513 | 0.77 | PTGDR2 (0.42) | KDM4EPTGDR2MEN1KMT2ALMNA | |
| SCHEMBL28099899 | 0.76 | KDM4E (0.38) | KDM4EPTGDR2 | |
| SCHEMBL27812451 | 0.75 | TDP1 (0.37) | KDM4ETDP1PTGDR2APEX1GPR17 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101389613-B | Macrocyclic factor viia inhibitors useful as anticoagulants | BRISTOL MYERS SQUIBB CO | 2011-10-12 | — | — | CN | disclosed |
| CN-101389613-A | Macrocyclic factor viia inhibitors useful as anticoagulants | BRISTOL MYERS SQUIBB CO (US) | 2009-03-18 | — | — | CN | disclosed |