Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PIM1 | P11309 | 3/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL769609 | 0.85 | CA1 (0.46) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL30135211 | 0.84 | CA1 (0.46) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL769553 | 0.83 | CA1 (0.55) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL29489130 | 0.81 | MCL1 (0.47) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL29663473 | 0.78 | GPR84 (0.53) | KDM4EGPR84ALDH1A1HPGDHSD17B10 | |
| SCHEMBL29110490 | 0.77 | MCL1 (0.49) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL29039496 | 0.74 | CA1 (0.50) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL32689890 | 0.74 | ALDH1A1 (0.48) | KDM4EGPR84CYP11B1ALDH1A1HPGD | |
| SCHEMBL13170778 | 0.74 | CA1 (0.55) | CA1CA2MCL1KDM4EPIM1 | |
| SCHEMBL16786545 | 0.73 | PIM1 (0.51) | CA1CA2MCL1KDM4EPIM1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2005200310-A | PHTHALOCYANINE DERIVATIVE HAVING CROWN ETHER RING IN MOLECULE AND INTERMEDIATE THEREFOR | NAGAOKA UNIV OF TECHNOLOGY | 2005-07-28 | — | — | JP | disclosed |