Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.55 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL79755 | 0.91 | CALM1 (0.67) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL27824048 | 0.88 | CALM1 (0.63) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL7201081 | 0.88 | CALM1 (0.63) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL27326360 | 0.88 | CALM1 (0.63) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL10337521 | 0.86 | CALM1 (0.60) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL27182261 | 0.84 | CALM1 (0.52) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL28293659 | 0.82 | CALM1 (0.55) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| Diphenylmethane SCHEMBL11592089 | 0.80 | CALM1 (0.67) | CALM1LTA4HKDM4ECYP3A4MAPT | |
| SCHEMBL320687 | 0.80 | CALM1 (0.44) | CALM1CYP3A4ALDH1A1KMT2A | |
| SCHEMBL5023667 | 0.77 | CALM1 (0.55) | CALM1LTA4HKDM4ECYP3A4MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1896040-B | Tolanes, process for their preparation and use thereof | MERCK PATENT GMBH | 2011-08-10 | — | — | CN | disclosed |
| CN-1896040-A | Tolanes, process for their preparation and use thereof | MERCK PATENT GMBH (DE) | 2007-01-17 | — | — | CN | disclosed |