Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 3/20 | 0.70 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.70 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.53 |
| ▸ | DHODH | Q02127 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | XDH | P47989 | 1/20 | 0.48 |
| ▸ | MYC | P01106 | 1/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | FABP3 | P05413 | 1/20 | 0.47 |
| ▸ | FABP4 | P15090 | 1/20 | 0.47 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.47 |
| ▸ | DCLRE1B | Q9H816 | 1/20 | 0.47 |
| ▸ | ACLY | P53396 | 1/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | HNF4A | P41235 | 1/20 | 0.46 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL787118 | 0.87 | AKR1C2 (0.70) | AKR1C2AKR1C1MCL1DHODHXDH | |
| SCHEMBL6496649 | 0.84 | AKR1C2 (0.68) | AKR1C2AKR1C1MCL1DHODHTSHR | |
| SCHEMBL120353 | 0.84 | ACMSD (0.63) | AKR1C2AKR1C1MCL1TSHRCASP1 | |
| SCHEMBL2770320 | 0.84 | TSHR (0.68) | AKR1C2AKR1C1TSHRCASP1SMN1; SMN2 | |
| SCHEMBL272091 | 0.83 | RXRB (0.57) | AKR1C2AKR1C1MCL1DHODHACLY | |
| SCHEMBL32665010 | 0.82 | AKR1C2 (0.50) | AKR1C2AKR1C1MCL1DHODHSMN1; SMN2 | |
| SCHEMBL2556733 | 0.81 | EIF4E (0.53) | AKR1C2AKR1C1TSHRCASP1SMN1; SMN2 | |
| SCHEMBL336771 | 0.80 | SMN1; SMN2 (0.63) | AKR1C2AKR1C1TSHRCASP1SMN1; SMN2 | |
| SCHEMBL9850077 | 0.78 | ACMSD (0.72) | AKR1C2AKR1C1MCL1DHODHHNF4A | |
| SCHEMBL2554092 | 0.78 | TRIM24 (0.62) | AKR1C2AKR1C1MCL1TSHRCASP1 |
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-6884821-B1 | Carboxylic acid derivatives and drugs containing the same | EISAI CO., LTD. (JP) | 2005-04-26 | — | — | US | disclosed |