Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.44 |
| ▸ | AR | P10275 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.43 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.42 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL8438703 | 0.86 | C5AR1 (0.49) | CA12CA9CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL8443447 | 0.82 | CYP19A1 (0.45) | CA12CA9CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL8486671 | 0.82 | ROCK2 (0.49) | CYP19A1CYP11B1CYP11B2KDM4EALDH1A1 | |
| SCHEMBL7359654 | 0.77 | PRMT5 (0.57) | CA12CA9CYP19A1ARLMNA | |
| SCHEMBL8441589 | 0.73 | CFTR (0.49) | CA12CA9CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL8438691 | 0.72 | F10 (0.44) | KDM4EALDH1A1C5AR1MAPTTDP1 | |
| SCHEMBL7360802 | 0.72 | C5AR1 (0.50) | KDM4EALDH1A1HSD17B10C5AR1PIK3R1 | |
| SCHEMBL8440152 | 0.70 | PRMT5 (0.52) | CA12CA9CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL28405041 | 0.70 | CYP3A4 (0.47) | CA12CA9CYP19A1CYP2A6P2RX3 | |
| SCHEMBL24327912 | 0.69 | RGS4 (0.43) | CA12CA9CYP19A1CYP11B1CYP11B2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5863914-A | ADMINISTERING TO HUMAN N,N-DIMETHYLBENZENE OR N,N-DIMETHYLNAPHTHALENE-CYCLIC UREA DERIVATIVE TO TREAT A DISEASE-STATE CAUSED BY INHIBITION OF FACTOR XA | MOHAN RAJU (US) | 1999-01-26 | — | — | US | disclosed |
| US-5859005-A | INHIBITORS OF THROMBIN AND FACTOR XA | BERLEX LABORATORIES, INC. (US) | 1999-01-12 | — | — | US | disclosed |
| US-5731308-A | N,N-di(aryl) cyclic urea derivatives as anti-coagulants | BERLEX LABORATORIES, INC. (US) | 1998-03-24 | — | — | US | disclosed |
| US-5731311-A | N,N-di(aryl) cyclic urea derivatives as anti-coagulants | BERLEX LABORATORIES, INC. (US) | 1998-03-24 | — | — | US | disclosed |
| US-5726198-A | FOR INHIBITING COAGULATION ENZYMES | BERLEX LABORATORIES, INC. (US) | 1998-03-10 | — | — | US | disclosed |
| US-5612363-A | FACTOR XA INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1997-03-18 | — | — | US | disclosed |