Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 7/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | SPR | P35270 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22410640 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRMGLLSPRADORA2A | |
| SCHEMBL22410664 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TSHRMGLLSPRADORA2A | |
| SCHEMBL13209769 | 0.74 | ALDH1A1 (0.67) | ALDH1A1TSHRLMNAPOLBKDM4E | |
| SCHEMBL6848735 | 0.73 | TSHR (0.49) | ALDH1A1TSHRMGLLSPRADORA2A | |
| SCHEMBL22410903 | 0.71 | ALDH1A1 (0.58) | ALDH1A1TSHRLMNAPOLBSPR | |
| SCHEMBL22410900 | 0.71 | ADORA2A (0.59) | ALDH1A1TSHRLMNAPOLBSPR | |
| SCHEMBL22410619 | 0.70 | ADORA2A (0.55) | ALDH1A1MGLLSPRADORA2AADORA1 | |
| SCHEMBL22410656 | 0.70 | KMT2A (0.50) | ALDH1A1TSHRMGLLADORA2AADORA1 | |
| SCHEMBL22410613 | 0.69 | ADORA2A (0.54) | ALDH1A1MGLLSPRADORA2AADORA1 | |
| SCHEMBL6848943 | 0.69 | TSHR (0.57) | ALDH1A1TSHRPOLBSPRADORA2A |
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-113710667-A | Fused cyclic pyrimidinone derivatives for the treatment of HBV infection or HBV induced diseases | 爱尔兰詹森科学公司 | 2021-11-26 | — | — | CN | claimed |
| CN-113710667-A | Fused cyclic pyrimidinone derivatives for the treatment of HBV infection or HBV induced diseases | 爱尔兰詹森科学公司 | 2021-11-26 | — | — | CN | disclosed |