Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | MC3R | P41968 | 1/20 | 0.43 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL15012541 | 0.84 | TSHR (0.57) | TSHRKDM4ENAPRTHCAR2ADORA3 | |
| SCHEMBL23407905 | 0.81 | CES2 (0.46) | KDM4ENAPRTUTS2RCHRNB2CHRNA4 | |
| SCHEMBL23418669 | 0.79 | ALDH1A1 (0.51) | HCAR2MKNK1MKNK2CHRNB2CHRNA4 | |
| SCHEMBL28184168 | 0.77 | KDM4E (0.42) | KDM4EUTS2R | |
| SCHEMBL23407891 | 0.75 | TMEM97 (0.41) | KDM4EPOLBKMT2A | |
| SCHEMBL13531267 | 0.74 | NPC1 (0.42) | TSHRHCAR2MAPTCYP1A2KMT2A | |
| SCHEMBL29771778 | 0.73 | CHRNB2 (0.46) | NAPRTUTS2RMKNK1MKNK2CHRNB2 | |
| SCHEMBL9563007 | 0.72 | TSHR (0.61) | TSHRKDM4ENAPRTHCAR2POLB | |
| SCHEMBL875263 | 0.72 | KDM4E (0.61) | TSHRKDM4ENAPRTHCAR2POLB | |
| SCHEMBL29556324 | 0.72 | KDM4E (0.61) | TSHRKDM4ENAPRTHCAR2POLB |
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-112079769-A | Carboxamide compounds for the treatment of metabolic disorders | 里格尔药品股份有限公司 | 2020-12-15 | — | — | CN | disclosed |
| CN-106928211-B | Carboxamide compounds for the treatment of metabolic disorders | 里格尔药品股份有限公司 | 2020-09-08 | — | — | CN | disclosed |