Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.39 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7693001 | 0.85 | AKR1C2 (0.49) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL8671630 | 0.84 | PTGS2 (0.42) | KDM4EMAPTGAAALDH1A1PTGS2 | |
| SCHEMBL6013487 | 0.82 | AKR1C2 (0.46) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL7698767 | 0.81 | AKR1C2 (0.46) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL3001361 | 0.80 | AKR1C2 (0.53) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL7698626 | 0.80 | GAA (0.49) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL2007216 | 0.80 | AKR1C2 (0.44) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL5496301 | 0.79 | AKR1C2 (0.46) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL9017471 | 0.79 | AKR1C2 (0.47) | AKR1C2KDM4EMAPTGAAALDH1A1 | |
| SCHEMBL7699710 | 0.78 | AKR1C2 (0.46) | AKR1C2KDM4EMAPTGAAALDH1A1 |
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-2002020478-A1 | N-BENZYLINDOLE-3-ACETIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF DRUG RESISTAN CANCER | DUBLIN CITY UNIVERSITY (IE) | 2002-03-14 | — | — | WO | disclosed |