Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 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 | |
|---|---|---|---|---|
| SCHEMBL27195151 | 0.83 | SIGMAR1 (0.54) | SIGMAR1FKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL27839561 | 0.82 | RIPK1 (0.45) | SMN1; SMN2ALDH1A1RIPK1 | |
| SCHEMBL634686 | 0.82 | RIPK1 (0.45) | SMN1; SMN2ALDH1A1RIPK1 | |
| SCHEMBL19880370 | 0.80 | SMN1; SMN2 (0.51) | SIGMAR1FKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18734805 | 0.80 | SMN1; SMN2 (0.51) | SIGMAR1FKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL19880369 | 0.80 | SMN1; SMN2 (0.51) | SIGMAR1FKBP1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL633700 | 0.78 | LMNA (0.41) | ALDH1A1 | |
| SCHEMBL14836855 | 0.76 | MMEL1 (0.52) | FKBP1ASMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL28152602 | 0.76 | ALDH1A1 (0.46) | SIGMAR1SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL3912914 | 0.75 | POLB (0.62) | FKBP1ASMN1; SMN2ALDH1A1MAPK1MMEL1 |
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-2022237747-A1 | SMALL MOLECULAR CD73 ANTAGONIST AND USE THEREOF | 四川海思科制药有限公司 | 2022-11-17 | — | — | WO | disclosed |