Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.43 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL311657 | 1.00 | KCNH2 (0.46) | KCNH2TP53PARP10AMPD2MMP13 | |
| SCHEMBL483795 | 0.88 | KCNH2 (0.54) | KCNH2PARP10OPRM1OPRD1MAOB | |
| SCHEMBL310676 | 0.88 | KCNH2 (0.54) | KCNH2PARP10OPRM1OPRD1MAOB | |
| SCHEMBL483784 | 0.85 | KCNH2 (0.51) | KCNH2MMP13ADAM17MAOB | |
| SCHEMBL483568 | 0.79 | KCNH2 (0.48) | KCNH2TP53NPC1RAB9A | |
| SCHEMBL2832438 | 0.78 | KCNH2 (0.51) | KCNH2TP53PARP10AMPD2OPRM1 | |
| SCHEMBL2831540 | 0.78 | KCNH2 (0.51) | KCNH2TP53PARP10AMPD2OPRM1 | |
| SCHEMBL840063 | 0.78 | KCNH2 (0.48) | KCNH2TP53PARP10AMPD2ADAM17 | |
| SCHEMBL841357 | 0.78 | KCNH2 (0.48) | KCNH2TP53PARP10AMPD2ADAM17 | |
| SCHEMBL310889 | 0.78 | KCNH2 (0.48) | KCNH2TP53PARP10AMPD2ADAM17 |
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 |
|---|---|---|---|---|---|---|---|
| US-8153623-B2 | Compounds | Convergence Pharmaceuticals Limited (GB) | 2012-04-10 | — | — | US | disclosed |
| EP-1934176-B1 | QUATERNARY ALPHA-AMINOCARBOXAMIDE DERIVATIVES AS MODULATORS OF VOLTAGE-GATED SODIUM CHANNELS | GLAXO GROUP LTD (GB) | 2012-02-01 | — | — | EP | disclosed |