Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KLK7 | P49862 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9772459 | 0.74 | PTGS2 (0.38) | KDM4EALDH1A1GAARAB9A | |
| SCHEMBL8829202 | 0.74 | KDM4E (0.41) | KDM4EALDH1A1GAAHPGDKLK7 | |
| SCHEMBL13178571 | 0.73 | KDM4E (0.34) | KDM4EALDH1A1GAAHPGDKLK7 | |
| SCHEMBL9772506 | 0.73 | ALDH1A1 (0.47) | KDM4EALDH1A1GAAHPGDKMT2A | |
| SCHEMBL103804 | 0.71 | NUDT1 (0.46) | KMT2AHTR6 | |
| SCHEMBL15760248 | 0.71 | ALDH1A1 (0.35) | KDM4EALDH1A1GAAHPGDKLK7 | |
| SCHEMBL14725911 | 0.70 | GRM5 (0.49) | KDM4EALDH1A1GAAHPGDKLK7 | |
| SCHEMBL8858892 | 0.70 | GRM5 (0.36) | KDM4EALDH1A1GAAHPGDRAB9A | |
| SCHEMBL397662 | 0.69 | NUDT1 (0.50) | KDM4EALDH1A1GAAHPGDKLK7 | |
| SCHEMBL3042386 | 0.69 | KDM4E (0.33) | KDM4EALDH1A1GAAHPGDKLK7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2637649-A2 | COMPOUNDS AND METHODS FOR TREATING PAIN | Akron Molecules GmbH (AT) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062925-A2 | COMPOUNDS AND METHODS FOR TREATING PAIN | AKRON MOLECULES GMBH (AT) | 2012-05-18 | — | — | WO | disclosed |
| WO-1997003055-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS FOR INHIBITING REPLICATION OF RETROVIRUSES AND FOR INHIBITING TUMOR PROMOTER INITIATED TRANSCRIPTION | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1997-01-30 | — | — | WO | disclosed |