Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.42 |
| ▸ | LCK | P06239 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
| ▸ | TUBB | P07437 | 1/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.34 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.34 |
| ▸ | TUBA1A | Q71U36 | 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 | |
|---|---|---|---|---|
| SCHEMBL15569789 | 0.83 | TUBB4A (0.41) | BRD4LCKTUBB4ATUBBTUBA3C | |
| SCHEMBL15569132 | 0.82 | BRD4 (0.45) | BRD4LCKGAAKDM4EALDH1A1 | |
| SCHEMBL15568577 | 0.76 | BRD4 (0.45) | BRD4LCKGAAKDM4EALDH1A1 | |
| SCHEMBL15569873 | 0.68 | BRD4 (0.38) | BRD4LCKGAAKDM4EALDH1A1 | |
| SCHEMBL19304040 | 0.62 | BRD4 (0.44) | BRD4KDM4EALDH1A1MAPTCYP1A2 | |
| SCHEMBL15568495 | 0.62 | BRD4 (0.39) | BRD4GAAKDM4EMAPTHTT | |
| SCHEMBL10768681 | 0.62 | PTGS2 (0.40) | BRD4KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL15568576 | 0.60 | SIRT5 (0.44) | BRD4GAAKDM4EALDH1A1MAPT | |
| SCHEMBL11808824 | 0.60 | PTGS2 (0.52) | KDM4EALDH1A1MAPTPTGS2TUBB1 | |
| SCHEMBL28963207 | 0.59 | PDE3B (0.58) | LCKKDM4EALDH1A1MAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2885299-A1 | INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A | AbbVie Deutschland GmbH & Co KG (DE) | 2015-06-24 | — | — | EP | disclosed |
| WO-2014027078-A1 | INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A | AbbVie Deutschland GmbH & Co. KG (DE) | 2014-02-20 | — | — | WO | disclosed |