Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.71 |
| ▸ | BCHE | P06276 | 7/20 | 0.65 |
| ▸ | ACHE | P22303 | 5/20 | 0.65 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7240526 | 0.83 | SIGMAR1 (1.00) | SIGMAR1BCHEACHEHRH3 | |
| SCHEMBL11836368 | 0.79 | LMNA (0.69) | BCHEALDH1A1HTTLMNASMN1; SMN2 | |
| SCHEMBL3146771 | 0.79 | BCHE (1.00) | SIGMAR1BCHEACHE | |
| SCHEMBL1853622 | 0.76 | LMNA (0.71) | SIGMAR1BCHEACHEALDH1A1HTT | |
| SCHEMBL11824360 | 0.76 | LMNA (0.71) | BCHEACHEALDH1A1HTTLMNA | |
| SCHEMBL8681467 | 0.75 | SMN1; SMN2 (0.50) | SIGMAR1ALDH1A1SMN1; SMN2MAPK14 | |
| SCHEMBL25403976 | 0.74 | LMNA (0.65) | SIGMAR1ALDH1A1HTTLMNASMN1; SMN2 | |
| SCHEMBL8471026 | 0.73 | HTR1A (0.82) | BCHEACHEHRH3CYP2D6 | |
| SCHEMBL6061877 | 0.73 | SMN1; SMN2 (0.65) | SIGMAR1ALDH1A1LMNASMN1; SMN2KMT2A | |
| SCHEMBL11841997 | 0.73 | ADRA2A (0.70) | LMNAKMT2AMEN1 |
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-5814644-A | Indole derivatives as dopamine D4 antagonists | MERCK SHARP & DOHME, LTD. (GB) | 1998-09-29 | — | — | US | disclosed |
| WO-1994024105-A1 | INDOLE DERIVATIVES AS DOPAMINE D4 ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1994-10-27 | — | — | WO | disclosed |