Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 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 | |
|---|---|---|---|---|
| SCHEMBL9532975 | 0.99 | TSHR (0.39) | TSHRCYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL9533440 | 0.99 | TSHR (0.39) | TSHRCYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL9534591 | 0.89 | MAPT (0.38) | TSHRCYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL9532198 | 0.80 | TSHR (0.53) | TSHRCYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL11800087 | 0.80 | TSHR (0.41) | TSHRALDH1A1MAPTSMN1; SMN2LMNA | |
| SCHEMBL9533307 | 0.78 | TSHR (0.52) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL9533982 | 0.78 | TSHR (0.52) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL11804290 | 0.76 | TSHR (0.47) | TSHRALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL10681336 | 0.76 | ALDH1A1 (0.43) | TSHRCYP1A2ALDH1A1CYP11B2KMT2A | |
| SCHEMBL11807301 | 0.76 | ALDH1A1 (0.52) | TSHRCYP1A2CYP2C9CYP2C19ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0360261-B1 | Substituted Imidazol[2,1-b] quinazolin-5(3H)-ones and related tricyclic compounds | MERRELL DOW PHARMA (US) | 1993-10-27 | — | — | EP | claimed |
| EP-0360261-A1 | Substituted Imidazol[2,1-b] quinazolin-5(3H)-ones and related tricyclic compounds | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-03-28 | — | — | EP | claimed |
| US-4871732-A | Substituted imidazo(2,1-b)quinazolin-5(3H)-ones and related tricyclic compounds and use as bronchodilators | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-10-03 | — | — | US | claimed |