Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | LTA4H | P09960 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 2/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | BCR | P11274 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9152375 | 0.80 | CA4 (0.68) | BACE1NPC1RAB9AKDM4ETDP1 | |
| SCHEMBL17283658 | 0.80 | CA4 (0.68) | BACE1NPC1RAB9AKDM4ETDP1 | |
| Biphenyl SCHEMBL11784329 | 0.80 | CA4 (0.68) | BACE1NPC1RAB9AKDM4ETDP1 | |
| SCHEMBL291776 | 0.80 | CA4 (0.68) | BACE1NPC1RAB9AKDM4ETDP1 | |
| SCHEMBL25502225 | 0.80 | BACE1 (0.47) | BACE1NPC1RAB9AKDM4ETDP1 | |
| SCHEMBL29220727 | 0.78 | CA4 (0.65) | BACE1NPC1RAB9AKDM4ETDP1 | |
| Hydrogen Sulfide SCHEMBL27551138 | 0.78 | CA4 (0.65) | BACE1NPC1RAB9AKDM4ETDP1 | |
| SCHEMBL28478235 | 0.78 | CA4 (0.65) | BACE1NPC1RAB9AKDM4ETDP1 | |
| Hydrogen Sulfide SCHEMBL27606827 | 0.78 | CA4 (0.65) | BACE1NPC1RAB9AKDM4ETDP1 | |
| Water SCHEMBL3540832 | 0.78 | CA4 (0.65) | BACE1NPC1RAB9AKDM4ETDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6376523-B1 | HYPOTENSIVE AGENTS; ANTIINFLAMMATORY AGENTS; ENDOGENOUS VASOCONSTRUCTION PEPTIDE | TEXAS BIOTECHNOLOGY CORPORATION | 2002-04-23 | — | — | US | disclosed |