Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | CTSV | O60911 | 2/20 | 0.38 |
| ▸ | CTSL | P07711 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | PPIA | P62937 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16738992 | 0.78 | MGMT (0.50) | MGMTTHRATHRBLMNAHTT | |
| SCHEMBL25367087 | 0.75 | MGMT (0.44) | MGMTTHRATHRBCTSVCTSL | |
| SCHEMBL16342378 | 0.74 | LMNA (0.48) | THRATHRBPOLBSMN1; SMN2CTSV | |
| SCHEMBL25368475 | 0.74 | THRA (0.43) | MGMTTHRATHRBPOLBSMN1; SMN2 | |
| SCHEMBL26039527 | 0.73 | CYP19A1 (0.43) | THRATHRBPOLBSMN1; SMN2CTSV | |
| SCHEMBL30510897 | 0.73 | CYP19A1 (0.43) | THRATHRBPOLBSMN1; SMN2CTSV | |
| SCHEMBL30318890 | 0.73 | MAPT (0.46) | MGMTPOLBSMN1; SMN2CTSVCTSL | |
| SCHEMBL21487362 | 0.73 | MAPT (0.46) | MGMTPOLBSMN1; SMN2CTSVCTSL | |
| SCHEMBL5843845 | 0.72 | NPC1 (0.49) | HTTMAPTNPC1 | |
| SCHEMBL7882301 | 0.70 | PTPN1 (0.44) | MGMTPTPN1POLBSMN1; SMN2CTSV |
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 |
|---|---|---|---|---|---|---|---|
| CN-116348472-A | Macrocyclic compounds | 旭化成制药株式会社 | 2023-06-27 | — | — | CN | disclosed |