Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER4 | P35408 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8271779 | 0.88 | PTGER4 (0.47) | PTGER4GAAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL13699783 | 0.84 | GAA (0.54) | GAAALDH1A1KDM4ESMN1; SMN2HTT | |
| SCHEMBL4350898 | 0.84 | PTGER4 (0.43) | PTGER4GAAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL13699771 | 0.82 | PTGER4 (0.40) | PTGER4ALDH1A1KDM4ESMN1; SMN2HTT | |
| SCHEMBL1093920 | 0.81 | ALDH1A1 (0.65) | GAAALDH1A1KDM4ESMN1; SMN2HTT | |
| SCHEMBL22122327 | 0.81 | GAA (0.52) | GAAALDH1A1KDM4ELMNACYP19A1 | |
| SCHEMBL17829696 | 0.81 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2HTTLMNATDP1 | |
| SCHEMBL6638954 | 0.81 | NPC1 (0.48) | ALDH1A1SMN1; SMN2HTTLMNATDP1 | |
| SCHEMBL19233819 | 0.80 | ALDH1A1 (0.70) | PTGER4ALDH1A1KDM4ELMNATDP1 | |
| SCHEMBL6641148 | 0.80 | ALDH1A1 (0.44) | PTGER4ALDH1A1KDM4ESMN1; SMN2HTT |
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-3712162-A1 | SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2020-09-23 | — | — | EP | disclosed |