Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.46 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.45 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | FPR1 | P21462 | 3/20 | 0.42 |
| ▸ | FPR2 | P25090 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20041901 | 1.00 | KDM1A (0.47) | KDM1AMAOAMAOBMAP2K1DDB1 | |
| SCHEMBL19559429 | 1.00 | KDM1A (0.47) | KDM1AMAOAMAOBMAP2K1DDB1 | |
| SCHEMBL18590503 | 0.81 | MAPT (0.42) | CYP3A4HTR2CALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL18590502 | 0.81 | MAPT (0.42) | CYP3A4HTR2CALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL18590508 | 0.81 | MAPT (0.42) | CYP3A4HTR2CALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL18590507 | 0.81 | MAPT (0.42) | CYP3A4HTR2CALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL6482507 | 0.79 | SLC6A3 (0.45) | GAAFPR1FPR2ALDH1A1TP53 | |
| SCHEMBL6482502 | 0.79 | SLC6A3 (0.45) | GAAFPR1FPR2ALDH1A1TP53 | |
| SCHEMBL6482499 | 0.79 | SLC6A3 (0.45) | GAAFPR1FPR2ALDH1A1TP53 | |
| SCHEMBL1901694 | 0.79 | ALDH1A1 (0.48) | MAOAMAOBGAAALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3305763-A1 | DEUTERATED OR ISOTOPICALLY LABELED UREA DERIVATIVES OR PHARMACOLOGICALLY ACCEPTABLE SALTS THEREOF USEFUL AS FPRL-1 AGONISTS | Kyorin Pharmaceutical Co., Ltd. (JP) | 2018-04-11 | — | — | EP | disclosed |