Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 2/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5363641 | 0.79 | TSHR (0.40) | TSHRALDH1A1APPPTGER1CYP1A2 | |
| SCHEMBL5355645 | 0.79 | TSHR (0.40) | TSHRALDH1A1APPPTGER1CYP1A2 | |
| SCHEMBL5363238 | 0.73 | SMN1; SMN2 (0.49) | TSHRALDH1A1PTGER1CYP1A2TDP1 | |
| SCHEMBL25252586 | 0.68 | NR1H2 (0.43) | ALDH1A1HTTNR1H2NR1H3FAAH | |
| SCHEMBL28815520 | 0.68 | SLC16A3 (0.51) | ALDH1A1NR1H2NR1H3FAAHMGLL | |
| SCHEMBL14348149 | 0.68 | TSHR (0.44) | TSHRALDH1A1PTGER1TDP1L3MBTL1 | |
| SCHEMBL5460039 | 0.68 | TSHR (0.40) | TSHRALDH1A1APPPTGER1TDP1 | |
| SCHEMBL3265521 | 0.66 | POLB (0.45) | HTTPTGER1CYP1A2SMN1; SMN2MAPT | |
| SCHEMBL30930499 | 0.65 | HTR2C (0.56) | TSHRNR1H2NR1H3FAAHMGLL | |
| SCHEMBL12359857 | 0.65 | TSHR (0.44) | TSHRALDH1A1MAOBCYP1A2L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |