Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.48 |
| ▸ | GCK | P35557 | 1/20 | 0.43 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 2/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3661674 | 0.81 | SIRT2 (0.47) | ALDH1A1KDM4EMEN1KMT2AMAPT | |
| SCHEMBL7512439 | 0.81 | PARP10 (0.48) | PARP10GCKCXCL8ALDH1A1ESR1 | |
| SCHEMBL7020144 | 0.76 | KDM4E (0.47) | KDM4EMAPTNTRK1PIM1MKNK1 | |
| SCHEMBL28164428 | 0.75 | MKNK1 (0.44) | KDM4EKMT2ANTRK1PIM1MKNK1 | |
| SCHEMBL27944963 | 0.74 | PARP10 (0.46) | PARP10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL792643 | 0.73 | PARP10 (0.46) | PARP10GCKCXCL8KDM4EMEN1 | |
| SCHEMBL15676592 | 0.73 | TRPA1 (0.38) | PARP10GCK | |
| SCHEMBL27569231 | 0.72 | PARP10 (0.51) | PARP10GCKCXCL8ALDH1A1ESR1 | |
| SCHEMBL16599507 | 0.72 | LMNA (0.46) | PARP10ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL16487053 | 0.71 | FYN (0.47) | ALDH1A1MAPTNPC1RAB9ASMN1; SMN2 |
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-2575461-A1 | SUBSTITUTED-6-METHYLNICOTINAMIDES AS MGLUR5 POSITIVE ALLOSTERIC MODULATORS | Vanderbilt University (US) | 2013-04-10 | — | — | EP | disclosed |
| WO-2011149963-A1 | SUBSTITUTED-6-METHYLNICOTINAMIDES AS MGLUR5 POSITIVE ALLOSTERIC MODULATORS | VANDERBILT UNIVERSITY (US) | 2011-12-01 | — | — | WO | disclosed |