Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MET | P08581 | 2/20 | 0.48 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6604459 | 0.93 | MAPT (0.52) | PARP1NPC1RAB9AMAPTPOLB | |
| SCHEMBL6602409 | 0.92 | MAPT (0.51) | PARP1NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL6607030 | 0.90 | NR1H4 (0.62) | NPC1ALDH1A1MAPTGAAPOLB | |
| SCHEMBL6603227 | 0.89 | MAPT (0.58) | PARP1HPGDNPC1RAB9AALDH1A1 | |
| SCHEMBL6606883 | 0.87 | PARP1 (0.51) | PARP1HPGDNPC1RAB9AALDH1A1 | |
| SCHEMBL6602810 | 0.85 | MCHR1 (0.54) | PARP1HPGDNPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL6604034 | 0.83 | MAPT (0.58) | HPGDALDH1A1SMN1; SMN2MAPTGAA | |
| SCHEMBL6604450 | 0.80 | ROCK1 (0.54) | PARP1NPC1RAB9AMAPTPOLB | |
| SCHEMBL6602401 | 0.80 | MAPT (0.51) | PARP1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL6603893 | 0.79 | MCHR1 (0.61) | PARP1HPGDNPC1ALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1102535-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2004-09-29 | — | — | EP | disclosed |
| EP-1102535-A2 | COMPOUNDS AND METHODS | SmithKline Beecham Corporation (US) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000006085-A2 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-02-10 | — | — | WO | disclosed |