Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9156553 | 0.81 | CA12 (0.52) | TSHRKDM4EALDH1A1CA12CA1 | |
| SCHEMBL910584 | 0.79 | NQO1 (0.58) | NQO1TSHRTDP1LTA4HSMN1; SMN2 | |
| SCHEMBL1235239 | 0.79 | NQO1 (0.58) | NQO1TSHRTDP1LTA4HSMN1; SMN2 | |
| SCHEMBL7773652 | 0.79 | NQO1 (0.58) | NQO1TSHRTDP1LTA4HSMN1; SMN2 | |
| SCHEMBL4137602 | 0.78 | PYCR1 (0.56) | TSHRLTA4HSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL19543259 | 0.78 | NQO1 (0.64) | NQO1TSHRTDP1LTA4HSMN1; SMN2 | |
| SCHEMBL10547183 | 0.78 | CACNA1C (0.43) | NQO1TSHRTDP1LTA4HSMN1; SMN2 | |
| SCHEMBL10548413 | 0.78 | LTA4H (0.54) | NQO1TSHRTDP1LTA4HSMN1; SMN2 | |
| SCHEMBL13883531 | 0.78 | GAA (0.57) | TSHRSMN1; SMN2LMNAKDM4EALDH1A1 | |
| SCHEMBL28344356 | 0.78 | ST14 (0.43) | TSHRTDP1LTA4HMEN1KMT2A |
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-1476438-B1 | OXA- AND THIADIAZOLES AND THEIR USE AS METALLOPROTEINASE INHIBITORS | VERNALIS R&D LTD (GB) | 2007-04-18 | — | — | EP | claimed |