Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL23084473 | 0.81 | CHRNB2 (0.39) | GRIN2BCHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL10683163 | 0.79 | CHRNB2 (0.44) | TSHRNPSR1PKMHPGDGRIN2B | |
| SCHEMBL13305787 | 0.79 | CHRNB2 (0.44) | TSHRNPSR1PKMHPGDGRIN2B | |
| SCHEMBL11765796 | 0.77 | TSHR (0.48) | TSHRNPSR1PKMHPGDGRIN2B | |
| SCHEMBL1473250 | 0.76 | PLAU (0.44) | TSHRGAASMN1; SMN2HTR2CHTR2B | |
| SCHEMBL8522807 | 0.75 | PDK1 (0.43) | TSHRNPSR1PKMHPGDGRIN2B | |
| SCHEMBL8554586 | 0.75 | TSHR (0.40) | TSHRNPSR1PKMHPGDGRIN2B | |
| SCHEMBL29746320 | 0.75 | PDK1 (0.48) | TSHRNPSR1PKMHPGD | |
| SCHEMBL9396982 | 0.74 | GAA (0.50) | TSHRGAASMN1; SMN2HTR2CHTR2B | |
| SCHEMBL20646025 | 0.74 | CHRM2 (0.47) | TSHRNPSR1CHRNB2CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0529452-B1 | 1,7-Condensed 3-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them | SOLVAY PHARM GMBH (DE) | 1998-11-11 | — | — | EP | disclosed |
| EP-0725068-A1 | INDOLE DERIVATIVE | TOKYO TANABE COMPANY LIMITED (JP) | 1996-08-07 | — | — | EP | disclosed |
| US-5324725-A | Antiinflammatory agent, antiallergen | KALI-CHEMIE PHARMA GMBH (DE) | 1994-06-28 | — | — | US | disclosed |
| EP-0529452-A2 | 1,7-Condensed 2-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them | Kali-Chemie Pharma GmbH (DE) | 1993-03-03 | — | — | EP | disclosed |