Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8440634 | 0.97 | CFTR (0.48) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL8908297 | 0.93 | CFTR (0.53) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL8441589 | 0.88 | CFTR (0.49) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL8908061 | 0.88 | CFTR (0.57) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL8439957 | 0.82 | CFTR (0.58) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL7359654 | 0.75 | PRMT5 (0.57) | HDAC8HDAC6HDAC1CYP19A1AR | |
| SCHEMBL8487543 | 0.75 | CFTR (0.54) | CFTRHDAC8HDAC6CNR1AR | |
| SCHEMBL7360668 | 0.74 | F2 (0.54) | — | |
| SCHEMBL7366139 | 0.73 | F10 (0.53) | — | |
| SCHEMBL8907770 | 0.73 | CFTR (0.49) | CFTRHDAC8HDAC6CNR1CYP19A1 |
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-5612363-A | FACTOR XA INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1997-03-18 | — | — | US | disclosed |