Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | F13A1 | P00488 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25683773 | 0.84 | NPC1 (0.53) | KDM4EF13A1TAAR1SMN1; SMN2LMNA | |
| SCHEMBL19088829 | 0.82 | ESRRG (0.50) | KDM4EF13A1SMN1; SMN2LMNAHPGD | |
| SCHEMBL6307134 | 0.82 | NPC1 (0.59) | TAAR1SMN1; SMN2LMNAHPGDALDH1A1 | |
| Water SCHEMBL17767324 | 0.80 | NPC1 (0.57) | TAAR1SMN1; SMN2LMNAALOX12HPGD | |
| SCHEMBL2093513 | 0.80 | KDM4E (0.72) | KDM4EF13A1SMN1; SMN2LMNAHPGD | |
| SCHEMBL20924880 | 0.79 | POLB (0.46) | L3MBTL1SMN1; SMN2LMNAALOX12HPGD | |
| SCHEMBL15580134 | 0.77 | KDM4E (0.53) | KDM4EF13A1L3MBTL1SMN1; SMN2EGLN1 | |
| SCHEMBL4511148 | 0.76 | KDM4E (0.52) | KDM4EF13A1SMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL12305065 | 0.76 | MAPT (0.70) | KDM4ETAAR1SMN1; SMN2LMNAHPGD | |
| SCHEMBL21357659 | 0.74 | IDO1 (0.68) | KDM4EL3MBTL1TAAR1SMN1; SMN2LMNA |
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-2418942-B1 | NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS | SANFORD-BURNHAM MEDICAL RES INST (US) | 2017-08-23 | — | — | EP | disclosed |
| EP-2033951-A2 | 2-Piperazine-pyridines useful for treating pain | EURO-CELTIQUE S.A. (LU) | 2009-03-11 | — | — | EP | disclosed |