Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHA2 | P29317 | 4/20 | 0.52 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.50 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.48 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.45 |
| ▸ | BUB1 | O43683 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15058339 | 0.90 | EPHA2 (0.49) | EPHA2ERBB2EPHB4NR1H4PDK1 | |
| SCHEMBL27983623 | 0.86 | PDK1 (0.48) | NR1H4PDK1DRD4HRH3MEN1 | |
| SCHEMBL28851224 | 0.86 | EPHA2 (0.51) | EPHA2ERBB2EPHB4NR1H4PDK1 | |
| SCHEMBL13482008 | 0.85 | EPHA2 (0.51) | EPHA2ERBB2EPHB4NR1H4PDK1 | |
| SCHEMBL4510923 | 0.85 | EPHA2 (0.54) | EPHA2ERBB2EPHB4NR1H4PDK1 | |
| SCHEMBL27340482 | 0.83 | EPHA2 (0.53) | EPHA2ERBB2EPHB4NR1H4PDK1 | |
| SCHEMBL1848811 | 0.82 | EPHA2 (0.50) | EPHA2ERBB2EPHB4PDK1BUB1 | |
| SCHEMBL13984639 | 0.82 | EPHA2 (0.50) | EPHA2ERBB2EPHB4PDK1BUB1 | |
| SCHEMBL1279962 | 0.81 | EPHA2 (0.47) | EPHA2ERBB2EPHB4DRD4SCN9A | |
| SCHEMBL1280969 | 0.81 | EPHA2 (0.47) | EPHA2ERBB2EPHB4DRD4SCN9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2794608-B1 | TETRAAZA-CYCLOPENTA[A]INDENYL AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS | MERCK PATENT GMBH (DE) | 2016-09-14 | — | — | EP | disclosed |
| US-9403835-B2 | Tetraaza-cyclopenta[a]indenyl and their use as positive allosteric modulators | ARES TRADING S.A. (CH) | 2016-08-02 | — | — | US | disclosed |
| EP-2794608-A1 | TETRAAZA-CYCLOPENTA[A]INDENYL AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS | Merck Patent GmbH (DE) | 2014-10-29 | — | — | EP | disclosed |
| EP-2674434-A1 | Tetraaza-cyclopenta[a]indenyl and their use as positive allosteric modulators | ARES TRADING S.A. (CH) | 2013-12-18 | — | — | EP | disclosed |
| WO-2013091773-A1 | TETRAAZA-CYCLOPENTA[A]INDENYL AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS | MERCK PATENT GMBH (DE) | 2013-06-27 | — | — | WO | disclosed |