Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 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 | |
|---|---|---|---|---|
| SCHEMBL3588654 | 0.83 | KDM4E (0.43) | TSHRGAAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL6930989 | 0.82 | EGFR (0.39) | TSHRKMT2AKDM4EALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL3588652 | 0.81 | KDM4E (0.43) | TSHRGAAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL1311876 | 0.81 | HSD17B10 (0.44) | GAANPSR1KDM4EHSD17B10 | |
| SCHEMBL1311858 | 0.79 | CYP2C19 (0.36) | TSHRKDM4EHSD17B10TDP1 | |
| Hydrochloric Acid SCHEMBL1311861 | 0.79 | HSD17B10 (0.43) | GAANPSR1KDM4EHSD17B10 | |
| SCHEMBL8891350 | 0.77 | GABRR1 (0.53) | KDM4EALDH1A1HSD17B10SMN1; SMN2HPGD | |
| SCHEMBL16064995 | 0.73 | QPCT (0.51) | TSHRKMT2AMEN1NPSR1KDM4E | |
| SCHEMBL5157739 | 0.72 | — | — | |
| SCHEMBL12844533 | 0.72 | — | — |
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-5140034-A | Hydroxytryptamine receptor antagonists; psychological and gastrointestinal disorders | MERCK SHARP & DOHME LTD. (GB) | 1992-08-18 | — | — | US | disclosed |