Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 11/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10942013 | 0.80 | HSD11B1 (0.76) | HSD11B1LMNAALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL1544701 | 0.74 | HSD11B1 (0.51) | HSD11B1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL14420292 | 0.73 | CCR1 (0.37) | HSD11B1LMNAALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL14557023 | 0.73 | LMNA (0.42) | HSD11B1LMNAALDH1A1RAB9AKDM4E | |
| SCHEMBL1544137 | 0.72 | HSD11B1 (0.56) | HSD11B1ALDH1A1TSHRKDM4E | |
| SCHEMBL22815745 | 0.71 | HSD11B1 (0.60) | HSD11B1LMNAALDH1A1NPC1RAB9A | |
| SCHEMBL392717 | 0.71 | HSD11B1 (0.53) | HSD11B1ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL2747163 | 0.68 | HSD11B1 (0.81) | HSD11B1 | |
| SCHEMBL14557028 | 0.67 | HSD11B1 (0.34) | HSD11B1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL1544604 | 0.67 | NPC1 (0.51) | HSD11B1LMNAALDH1A1SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6472392-B1 | Triazole compounds and the use thereof as dopamine-D3 -ligands | ABBOTT LABORATORIES | 2002-10-29 | — | — | US | disclosed |
| EP-0994865-B1 | TRIAZOLE COMPOUNDS AND THE USE THEREOF AS DOPAMINE-D 3-LIGANDS | BASF AG (DE) | 2002-03-06 | — | — | EP | disclosed |