Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | PYGL | P06737 | 1/20 | 0.34 |
| ▸ | PYGM | P11217 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11135182 | 0.91 | KMT2A (0.41) | ALDH1A1HSD17B10GAAKMT2AHPGD | |
| Hydrochloric Acid SCHEMBL11559023 | 0.90 | KMT2A (0.40) | ALDH1A1HSD17B10GAAKMT2AHPGD | |
| SCHEMBL11056418 | 0.87 | RECQL (0.38) | ALDH1A1RECQLKDM4EHSD17B10GAA | |
| SCHEMBL11059255 | 0.86 | ABL1 (0.40) | ALDH1A1RORCESR1HDAC6HTT | |
| SCHEMBL11560412 | 0.85 | KMT2A (0.37) | ALDH1A1KDM4EHSD17B10GAAKMT2A | |
| SCHEMBL11061778 | 0.85 | ALDH1A1 (0.38) | ALDH1A1KDM4EHSD17B10GAAKMT2A | |
| Hydrochloric Acid SCHEMBL11133882 | 0.85 | ABL1 (0.40) | ALDH1A1GAARORCESR1HDAC6 | |
| SCHEMBL11054409 | 0.84 | ESR1 (0.39) | ALDH1A1RECQLHPGDRORCESR1 | |
| SCHEMBL11053218 | 0.84 | RORC (0.35) | ALDH1A1KMT2ARORCSMN1; SMN2ESR1 | |
| SCHEMBL11053340 | 0.84 | ALDH1A1 (0.36) | ALDH1A1HPGDRORCSMN1; SMN2ESR1 |
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-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 |
| US-4147804-A | ANTIARRHYTHMIA AGENTS | WILLIAM H. RORER, INC. (US) | 1979-04-03 | — | — | US | disclosed |