Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 6/20 | 0.36 |
| ▸ | DRD2 | P14416 | 4/20 | 0.36 |
| ▸ | DRD4 | P21917 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16223438 | 0.83 | TSHR (0.58) | TSHRNPSR1MEN1KMT2AMAPT | |
| SCHEMBL16223395 | 0.83 | TSHR (0.58) | TSHRNPSR1MEN1KMT2AMAPT | |
| SCHEMBL758937 | 0.83 | TSHR (0.58) | TSHRNPSR1MEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL27527995 | 0.83 | POLB (0.45) | TSHRNPSR1CYP2D6CYP3A4DRD1 | |
| SCHEMBL4782634 | 0.81 | PNMT (0.38) | TSHRNPSR1CYP2D6CYP3A4DRD1 | |
| SCHEMBL16393860 | 0.79 | ADAM10 (0.45) | TSHRNPSR1MEN1KMT2AALDH1A1 | |
| SCHEMBL16393804 | 0.79 | ADAM10 (0.42) | NPSR1MEN1KMT2ADRD3LMNA | |
| SCHEMBL488009 | 0.77 | PTPRF (0.46) | NPSR1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL28709213 | 0.77 | TDP1 (0.44) | TSHRMEN1KMT2AMAPK1TP53 | |
| Formaldehyde SCHEMBL28256666 | 0.75 | MAPK1 (0.36) | TSHRCYP2D6CYP3A4MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1169338-B1 | LOW-MOLECULAR INHIBITORS OF COMPLEMENT PROTEASES | ABBOTT GMBH & CO KG (DE) | 2004-11-03 | — | — | EP | disclosed |