Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CA7 | P43166 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.58 |
| ▸ | PARP14 | Q460N5 | 2/20 | 0.56 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.56 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14209216 | 0.90 | ALDH1A1 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4733674 | 0.90 | ALDH1A1 (0.52) | ALDH1A1TP53HPGDLMNAMAPT | |
| SCHEMBL4175647 | 0.89 | PARP10 (0.56) | PARP14PARP10ALDH1A1TP53HPGD | |
| SCHEMBL4197739 | 0.88 | FASN (0.61) | ALDH1A1TP53HPGDMAPTFASN | |
| SCHEMBL16799271 | 0.88 | HPGD (0.50) | ALDH1A1TP53HPGDLMNATSHR | |
| SCHEMBL4191753 | 0.88 | PARP10 (0.58) | PARP14PARP10HSD11B1ALDH1A1TP53 | |
| SCHEMBL4731334 | 0.85 | FASN (0.63) | PARP14PARP10HSD11B1ALDH1A1HPGD | |
| SCHEMBL4735697 | 0.85 | LMNA (0.51) | PARP10HSD11B1ALDH1A1TP53HPGD | |
| SCHEMBL4195205 | 0.85 | ALDH1A1 (0.48) | ALDH1A1TP53HPGDLMNAFASN | |
| SCHEMBL14210109 | 0.85 | KDM4E (0.47) | CA12CA1CA2CA7CA9 |
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-2008059214-A1 | BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS | ASTRAZENECA AB (SE) | 2008-05-22 | — | — | WO | disclosed |