Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | PARP1 | P09874 | 4/20 | 0.47 |
| ▸ | GRK2 | P25098 | 1/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 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 | |
|---|---|---|---|---|
| SCHEMBL6587773 | 0.88 | PARP1 (0.46) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL6806945 | 0.84 | PARP1 (0.60) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL6589817 | 0.83 | PIM1 (0.41) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL6590569 | 0.81 | L3MBTL1 (0.48) | KDM4EPARP1 | |
| SCHEMBL6588173 | 0.79 | PARP1 (0.49) | ALDH1A1PARP1MEN1KMT2A | |
| SCHEMBL6588299 | 0.76 | PARP1 (0.47) | ALDH1A1NPC1MAPTSMN1; SMN2PARP1 | |
| SCHEMBL6587182 | 0.76 | MEN1 (0.52) | KDM4EALDH1A1HPGDHSD17B10LMNA | |
| SCHEMBL6587303 | 0.75 | EPHX2 (0.52) | PARP1 | |
| SCHEMBL7479706 | 0.74 | PARP1 (0.49) | PARP1 | |
| SCHEMBL6587520 | 0.73 | PARP1 (0.46) | ALDH1A1NPC1LMNAMAPTRAB9A |
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-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |
| WO-2001082877-A2 | USE OF PARP INHIBITORS IN COSMETIC PREPARATIONS | BASF AKTIENGESELLSCHAFT (DE) | 2001-11-08 | — | — | WO | disclosed |