Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | COMT | P21964 | 1/20 | 0.42 |
| ▸ | GABRP | O00591 | 3/20 | 0.40 |
| ▸ | GABRD | O14764 | 3/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18356513 | 0.84 | HPGDS (0.44) | ESR1LMNARAB9AHPGDSCOMT | |
| SCHEMBL10652832 | 0.83 | HPGDS (0.40) | ESR1LMNACYP1A2SMN1; SMN2HIF1A | |
| SCHEMBL2225245 | 0.81 | HPGDS (0.50) | ESR1LMNACYP1A2RAB9AHPGDS | |
| SCHEMBL14190000 | 0.80 | HPGDS (0.49) | ESR1LMNACYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL4879887 | 0.78 | COMT (0.49) | ESR1RAB9ASMN1; SMN2HPGDSCOMT | |
| SCHEMBL6498481 | 0.77 | GABRB2 (0.52) | LMNACYP1A2RAB9ASMN1; SMN2GABRA1 | |
| SCHEMBL1314013 | 0.76 | RAB9A (0.53) | LMNARAB9ASMN1; SMN2HPGDSCOMT | |
| SCHEMBL8669626 | 0.76 | MAP4K4 (0.48) | LMNAHPGDSCOMTKMT2APDE3B | |
| SCHEMBL6547472 | 0.72 | CYP11B1 (0.50) | ESR1LMNAFFAR1HPGDSCOMT | |
| SCHEMBL10991522 | 0.71 | FFAR1 (0.45) | ESR1LMNAFFAR1CYP1A2RAB9A |
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-4521416-A | 4,5-Dihydro-6-[(substituted)-1H-imidazol-4-yl or 5-yl]-3(2H)-pyridazinones and 6-[(substituted)-1H-imidazol-4-yl or 5-yl]-3(2H)-pyridazinones | WARNER-LAMBERT COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0125749-A2 | Imidazolyl-pyridazinones | WARNER-LAMBERT COMPANY (US) | 1984-11-21 | — | — | EP | disclosed |