Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.60 |
| ▸ | CA1 | P00915 | 3/20 | 0.55 |
| ▸ | CA2 | P00918 | 3/20 | 0.55 |
| ▸ | CA7 | P43166 | 3/20 | 0.55 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28068214 | 0.86 | MAPT (0.62) | HTTCA1CA2CA7CA13 | |
| SCHEMBL4743191 | 0.84 | HTT (0.61) | HTTCA1CA2CA7CA13 | |
| SCHEMBL8562625 | 0.83 | HTT (0.67) | HTTCA1CA2CA7CA13 | |
| SCHEMBL30983973 | 0.81 | HTT (0.71) | HTTCA1CA2CA7CA13 | |
| SCHEMBL18359454 | 0.80 | PGK1 (0.48) | HTTMAPTKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16345563 | 0.78 | PIN1 (0.52) | HTTCA1CA2CA7CA13 | |
| SCHEMBL2572082 | 0.78 | HTT (0.50) | HTTCA1CA2CA7CA13 | |
| SCHEMBL5033956 | 0.76 | HTT (0.52) | HTTCA1CA2CA7CA13 | |
| SCHEMBL31631301 | 0.75 | NPC1 (0.74) | HTTCA1CA2CA7CA13 | |
| SCHEMBL1738419 | 0.75 | NPC1 (0.74) | HTTCA1CA2CA7CA13 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005121094-A1 | PIPERAZINE AND PIPERIDINE DERIVATIVES AS ANTI-HIV-AGENTS | PFIZER LIMITED (GB) | 2005-12-22 | — | — | WO | disclosed |