Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11003097 | 0.83 | KMT2A (0.39) | TSHRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11626066 | 0.83 | POLB (0.41) | TSHRCYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL11625289 | 0.81 | KDM4E (0.43) | TSHRCYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL11375095 | 0.81 | CYP3A4 (0.39) | TSHRCYP3A4CYP2C19LMNAPOLB | |
| SCHEMBL11624146 | 0.80 | TSHR (0.40) | TSHRLMNAPOLBALDH1A1L3MBTL1 | |
| SCHEMBL11381103 | 0.78 | KCNA5 (0.40) | TSHRLMNAPOLBALDH1A1L3MBTL1 | |
| SCHEMBL11628340 | 0.78 | MAPT (0.39) | TSHRCYP3A4LMNAPOLBALDH1A1 | |
| SCHEMBL11460905 | 0.78 | GAA (0.46) | TSHRCYP3A4CYP2C9LMNAPOLB | |
| SCHEMBL11381545 | 0.78 | POLB (0.39) | TSHRCYP1A2CYP2C9CYP2C19LMNA | |
| SCHEMBL11007676 | 0.75 | ALDH1A1 (0.40) | TSHRLMNAPOLBALDH1A1L3MBTL1 |
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-4112095-A | 6-Phenyl-1,2,4-triazolo[4,3-b]pyridazine hypotensive agents | AMERICAN CYANAMID COMPANY (US) | 1978-09-05 | — | — | US | disclosed |