Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | MMP2 | P08253 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MGAM | O43451 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27872024 | 0.82 | KDM4E (0.70) | KDM4EKMT2AMMP2TSHRALOX15 | |
| Benzene SCHEMBL27888317 | 0.80 | KDM4E (0.68) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL2553539 | 0.80 | ALDH1A1 (0.57) | KDM4EKMT2APIM1ALDH1A1 | |
| SCHEMBL1088781 | 0.80 | KDM4E (0.67) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL7143621 | 0.79 | KDM4E (0.68) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL30170409 | 0.79 | KDM4E (0.68) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL29697210 | 0.79 | KDM4E (1.00) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL171491 | 0.79 | KDM4E (1.00) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL31385428 | 0.78 | KDM4E (0.66) | KDM4EKMT2AMMP2TSHRALOX15 | |
| SCHEMBL4751890 | 0.78 | KDM4E (0.66) | KDM4EKMT2AMMP2TSHRALOX15 |
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-2403833-A1 | 8-SUBSTITUTED QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS | Sirtris Pharmaceuticals, Inc. (US) | 2012-01-11 | — | — | EP | disclosed |
| WO-2010101949-A1 | 8-SUBSTITUTED QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2010-09-10 | — | — | WO | disclosed |
| WO-2010101949-A1 | 8-SUBSTITUTED QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2010-09-10 | — | — | WO | disclosed |