Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.56 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ACLY | P53396 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | CCR2 | P41597 | 1/20 | 0.48 |
| ▸ | NFKBIA | P25963 | 2/20 | 0.48 |
| ▸ | RELA | Q04206 | 2/20 | 0.48 |
| ▸ | SLC40A1 | Q9NP59 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | SGK1 | O00141 | 1/20 | 0.46 |
| ▸ | EDNRA | P25101 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7448331 | 0.86 | SLC22A12 (0.62) | PTGES2SLC22A12TSHRACLYALDH1A1 | |
| SCHEMBL30737433 | 0.79 | PTGES2 (0.56) | PTGES2SLC22A12ALDH1A1NFKBIARELA | |
| SCHEMBL30737510 | 0.79 | CA1 (0.50) | PTGES2ACLYNFKBIARELASLC40A1 | |
| SCHEMBL3022491 | 0.79 | PTGES2 (0.52) | PTGES2SLC22A12TSHRACLYALDH1A1 | |
| SCHEMBL7213147 | 0.78 | TSHR (0.64) | PTGES2SLC22A12TSHRACLYALDH1A1 | |
| SCHEMBL7594059 | 0.76 | CCR2 (0.55) | PTGES2SLC22A12TSHRACLYALDH1A1 | |
| SCHEMBL6561655 | 0.76 | MEN1 (0.66) | TSHRKMT2AMEN1 | |
| SCHEMBL29118847 | 0.76 | ALDH1A1 (0.65) | ALDH1A1KMT2ATDP1MEN1CA1 | |
| SCHEMBL30737629 | 0.76 | MEN1 (0.66) | TSHRKMT2AMEN1 | |
| SCHEMBL7163015 | 0.74 | ALDH1A1 (0.68) | ALDH1A1KMT2ATDP1MEN1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117510460-A | Benzo [ b ] thiophene derivative containing sulfonamide unit, and preparation method and application thereof | 贵州大学 | 2024-02-06 | — | — | CN | disclosed |