Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11060096 | 0.90 | ALDH1A1 (0.36) | LMNAGAAHTTSMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL11141378 | 0.89 | GRIN2D (0.35) | LMNAGAAHTTSMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL11137243 | 0.86 | HTT (0.35) | PKMLMNAGAAIDO1HTT | |
| SCHEMBL11055264 | 0.85 | ALDH1A1 (0.38) | GAAHTTSMN1; SMN2KMT2AEGFR | |
| SCHEMBL10614640 | 0.85 | TP53 (0.35) | LMNAGAAIDO1HTTSMN1; SMN2 | |
| SCHEMBL11142932 | 0.84 | KMT2A (0.34) | PKMGAAHTTSMN1; SMN2KMT2A | |
| SCHEMBL11053970 | 0.82 | GAA (0.39) | LMNAGAAHTTSMN1; SMN2KMT2A | |
| Hydrochloric Acid SCHEMBL11141193 | 0.81 | GAA (0.38) | LMNAGAAHTTSMN1; SMN2KMT2A | |
| SCHEMBL11053330 | 0.79 | ALDH1A1 (0.35) | LMNAIDO1HTTSMN1; SMN2TAAR1 | |
| SCHEMBL11057730 | 0.78 | ALDH1A1 (0.35) | GAASMN1; SMN2KMT2ATP53CACNA1C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4452980-A | DIARRHEA | WILLIAM H. RORER, INC. (US) | 1984-06-05 | — | — | US | disclosed |
| US-4418209-A | ANTIULCER, ANTIARRYTHMIC, ANTIDIARRHEAL, ANTISPASMODIC, ANTIPARASITIC, AND ANTISECRETORY AGENTS | WILLIAM H. RORER, INC. (US) | 1983-11-29 | — | — | US | disclosed |
| US-4246409-A | ANTIDIARRHEAL AGENTS | WILLIAM H. RORER, INC. (US) | 1981-01-20 | — | — | US | disclosed |
| US-4225315-A | Triazinones from amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-30 | — | — | US | disclosed |