Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | TLR2 | O60603 | 2/20 | 0.35 |
| ▸ | KLK7 | P49862 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19063617 | 0.88 | ABCB1 (0.44) | MAPTABCB1HTTSMN1; SMN2KLK7 | |
| SCHEMBL20549158 | 0.88 | ABCB1 (0.44) | MAPTABCB1HTTSMN1; SMN2KLK7 | |
| SCHEMBL500503 | 0.79 | MEN1 (0.44) | CYP3A4PIK3CDHTTSMN1; SMN2CYP2D6 | |
| SCHEMBL3868085 | 0.78 | MEN1 (0.43) | CYP3A4PIK3CDHTTSMN1; SMN2CYP2D6 | |
| SCHEMBL19100844 | 0.76 | L3MBTL1 (0.47) | TSHRL3MBTL1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL12258922 | 0.76 | PREP (0.41) | ALDH1A1CYP3A4MAPK1MAPTHTT | |
| SCHEMBL31566991 | 0.75 | ABCB1 (0.46) | MAPTABCB1HTTSMN1; SMN2KLK7 | |
| SCHEMBL13382281 | 0.75 | ABCB1 (0.46) | MAPTABCB1HTTSMN1; SMN2KLK7 | |
| SCHEMBL5781598 | 0.74 | SMN1; SMN2 (0.47) | CYP3A4HTTSMN1; SMN2CYP2D6CYP2C19 | |
| SCHEMBL3333381 | 0.74 | ALDH1A1 (0.51) | TSHRL3MBTL1ALDH1A1CYP3A4TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3400228-A1 | FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF | Tabomedex Biosciences, LLC (US) | 2018-11-14 | — | — | EP | disclosed |
| WO-2017120164-A1 | FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF | Tabomedex Biosciences, LLC (US) | 2017-07-13 | — | — | WO | disclosed |