Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 4/20 | 0.39 |
| ▸ | RXRB | P28702 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.37 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8780448 | 0.71 | PDE7A (0.45) | ALDH1A1SMN1; SMN2PDE7APDE7BKDM4E | |
| SCHEMBL8780486 | 0.70 | NR1H4 (0.39) | TSHRSRD5A2ALDH1A1PDE7APDE7B | |
| SCHEMBL12847433 | 0.68 | TSHR (0.44) | TSHRKDM4E | |
| SCHEMBL11249938 | 0.67 | TDP1 (0.45) | TSHRALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4058443 | 0.67 | ADAM17 (0.54) | TSHRSRD5A2ALDH1A1NPC1RAB9A | |
| SCHEMBL9118013 | 0.67 | AGTR1 (0.47) | TSHRALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27986872 | 0.66 | TSHR (0.69) | TSHRSRD5A2ALDH1A1RXRARXRB | |
| SCHEMBL22768845 | 0.66 | GPR84 (0.61) | TSHRTP53KDM4ELMNA | |
| SCHEMBL3967865 | 0.66 | ADAM17 (0.57) | TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL20370925 | 0.66 | TSHR (0.63) | TSHRSRD5A2SMN1; SMN2NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0498722-B1 | Bicyclic nitrogen compounds, their preparation, intermediates obtained, their use as pharmaceuticals and pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1997-07-30 | — | — | EP | disclosed |
| EP-0498722-A1 | Bicyclic nitrogen compounds, their preparation, intermediates obtained, their use as pharmaceuticals and pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1992-08-12 | — | — | EP | disclosed |