Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 4/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30052019 | 1.00 | TSHR (0.45) | TSHRKDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL27186379 | 0.87 | TSHR (0.44) | TSHRKDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL31211411 | 0.79 | TSHR (0.47) | TSHRKDM4EALDH1A1L3MBTL1POLB | |
| SCHEMBL21458300 | 0.79 | TSHR (0.47) | TSHRKDM4EALDH1A1L3MBTL1POLB | |
| SCHEMBL27186999 | 0.77 | HSD17B10 (0.49) | TSHRKDM4EALDH1A1HPGDMETAP2 | |
| SCHEMBL29023121 | 0.77 | JAK3 (0.42) | TSHRKDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL30969311 | 0.77 | TSHR (0.47) | TSHRKDM4EALDH1A1L3MBTL1POLB | |
| SCHEMBL31638752 | 0.76 | TSHR (0.38) | TSHRKDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL20577534 | 0.76 | AXL (0.37) | KDM4EALDH1A1HPGDMETAP2AXL | |
| SCHEMBL12869690 | 0.75 | PIM3 (0.47) | KDM4EALDH1A1HPGDNPSR1L3MBTL1 |
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-116348453-A | Heteroaromatic carboxamide compounds and uses thereof | 烨辉医药科技(上海)有限公司 | 2023-06-27 | — | — | CN | disclosed |
| WO-2022228302-A1 | HETEROAROMATIC CARBOXAMIDE COMPOUNDS AND ITS USE | BIONOVA PHARMACEUTICALS (SHANGHAI) LIMITED (CN) | 2022-11-03 | — | — | WO | disclosed |