Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | ASPH | Q12797 | 2/20 | 0.43 |
| ▸ | KDM8 | Q8N371 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | AGER | Q15109 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29469492 | 0.87 | L3MBTL1 (0.45) | TACR1KDM4EASPHKDM8ALDH1A1 | |
| SCHEMBL28706970 | 0.81 | TACR1 (0.42) | TACR1KDM4EASPHKDM8ALDH1A1 | |
| SCHEMBL15018248 | 0.80 | KDM4E (0.55) | KDM4EASPHKDM8ALDH1A1MAPT | |
| SCHEMBL29175509 | 0.79 | TACR1 (0.43) | TACR1KDM4EASPHKDM8ALDH1A1 | |
| SCHEMBL29469503 | 0.77 | TACR1 (0.49) | TACR1KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL29469494 | 0.73 | KDM4C (0.49) | TACR1KDM4EASPHKDM8ALDH1A1 | |
| SCHEMBL14362843 | 0.70 | KDM4E (0.52) | KDM4EASPHKDM8ALDH1A1MAPT | |
| SCHEMBL31037167 | 0.70 | KDM4E (0.55) | KDM4EASPHKDM8ALDH1A1MAPT | |
| SCHEMBL29469478 | 0.70 | KMT2A (0.52) | TACR1KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL22660327 | 0.69 | TACR1 (0.40) | TACR1KDM4EALDH1A1TSHRATM |
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-114206443-B | Aromatic or heteroaromatic ring derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-114206443-A | Aromatic ring or heteroaromatic ring derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2022-03-18 | — | — | CN | disclosed |