Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP7 | P09237 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8404245 | 0.92 | CAPN1 (0.42) | CA2CA1CA7CA9CA4 | |
| SCHEMBL8406510 | 0.91 | MMP2 (0.38) | CA2CA1CA7CA9CA4 | |
| SCHEMBL8403868 | 0.91 | MMP13 (0.45) | HSD17B10ALDH1A1HPGDMMP1MMP2 | |
| SCHEMBL8407604 | 0.86 | NR3C1 (0.39) | CAPN1CAPNS1 | |
| SCHEMBL8404228 | 0.86 | CAPN1 (0.43) | KMT2AMEN1TSHRALDH1A1KDM4E | |
| SCHEMBL8808273 | 0.84 | SLC1A3 (0.39) | CA2CA1CA7HSD17B10ALDH1A1 | |
| SCHEMBL8807411 | 0.84 | CA2 (0.52) | CA2CA1CA7CA9CA4 | |
| SCHEMBL8810081 | 0.84 | CAPN1 (0.49) | KMT2AAIMP2MEN1TSHRHTT | |
| SCHEMBL8810089 | 0.84 | CAPN1 (0.49) | KMT2AAIMP2MEN1TSHRHTT | |
| SCHEMBL8406506 | 0.84 | CA1 (0.39) | CA2CA1CA7CA9CA4 |
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-0810221-A1 | OXYGEN-CONTAINING HETEROCYCLIC DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-12-03 | — | — | EP | disclosed |