Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TPMT | P51580 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL26208 | 0.80 | KMT2A (0.41) | TSHRKDM4ELMNAALDH1A1GAA | |
| SCHEMBL8035709 | 0.79 | GPR35 (0.45) | CA12CA1CA2CA4CA6 | |
| SCHEMBL3982009 | 0.75 | PPARG (0.55) | CA12CA1CA2CA4CA6 | |
| SCHEMBL30362191 | 0.75 | PPARG (0.55) | CA12CA1CA2CA4CA6 | |
| SCHEMBL113522 | 0.75 | CA12 (0.53) | CA12CA1CA2CA4CA6 | |
| SCHEMBL2156903 | 0.71 | MTNR1B (0.40) | CNR2TSHRLMNAALDH1A1GAA | |
| SCHEMBL2156670 | 0.70 | AKR1C3 (0.48) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL27365966 | 0.70 | ALDH1A1 (0.50) | CA12CA1CA9ALDH1A1GAA | |
| SCHEMBL5241843 | 0.70 | AKR1C3 (0.48) | TSHRKDM4EALDH1A1GAAMAPT | |
| SCHEMBL17047591 | 0.69 | TSHR (0.52) | TSHRLMNAALDH1A1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0987250-A1 | INDOLE DICARBOXYLIC ACID DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 2000-03-22 | — | — | EP | disclosed |