Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 11/20 | 0.52 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.47 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.47 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.43 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3021566 | 1.00 | SMN1; SMN2 (0.60) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL3435026 | 0.95 | MEN1 (0.62) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL19936511 | 0.94 | SMN1; SMN2 (0.62) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL3029049 | 0.87 | SMN1; SMN2 (0.64) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL24330982 | 0.82 | SMN1; SMN2 (0.63) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL10176954 | 0.81 | ALDH1A1 (0.43) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL830906 | 0.80 | KDM4E (0.60) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL11307987 | 0.80 | ACHE (0.57) | MEN1KMT2AALDH1A1TP53MAPT | |
| SCHEMBL8381311 | 0.79 | MAPT (0.48) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL17221115 | 0.78 | SMN1; SMN2 (0.79) | SMN1; SMN2MEN1KMT2AALDH1A1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114656486-B | Purinone compound, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2023-09-19 | — | — | CN | disclosed |
| CN-114656486-A | Purine ketone compound, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-06-24 | — | — | CN | disclosed |