Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3636591 | 0.74 | ADORA1 (0.39) | CCR8KMT2AALDH1A1FTOMAOA | |
| SCHEMBL7016170 | 0.67 | PARP1 (0.33) | ALDH1A1MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL12663310 | 0.65 | CCR8 (0.42) | CCR8KMT2AALDH1A1ADORA2AADORA1 | |
| SCHEMBL126092 | 0.65 | PARP1 (0.42) | CCR8KMT2AALDH1A1FTOMAOA | |
| SCHEMBL30774416 | 0.64 | CCR8 (1.00) | CCR8KMT2AALDH1A1ADORA2AADORA1 | |
| SCHEMBL12410495 | 0.64 | CCR8 (0.56) | CCR8KMT2AALDH1A1ADORA2AADORA1 | |
| SCHEMBL19318056 | 0.64 | CCR8 (1.00) | CCR8KMT2AALDH1A1ADORA2AADORA1 | |
| SCHEMBL2114197 | 0.64 | CCR8 (0.45) | CCR8KMT2AALDH1A1FTOMAOA | |
| SCHEMBL7835687 | 0.62 | KDM4E (0.43) | KMT2AALDH1A1HSD17B10KDM4ESMN1; SMN2 | |
| SCHEMBL660982 | 0.61 | PARP1 (0.42) | ALDH1A1MAOAMAOBHSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009125191-A1 | BENZENE DERIVATIVES | UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) | 2009-10-15 | — | — | WO | disclosed |