Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 6/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | 0.85 | TSHR (0.40) | TSHRHTR2CSLC6A4HTR2AALDH1A1 | |
| SCHEMBL5464352 | 0.79 | TSHR (0.40) | TSHRHTR2CSLC6A4HTR2AALDH1A1 | |
| SCHEMBL5363238 | 0.73 | SMN1; SMN2 (0.49) | TSHRALDH1A1PTGER1CYP1A2MAPT | |
| SCHEMBL12097815 | 0.69 | TSHR (0.45) | TSHRALDH1A1APPCYP1A2MAPT | |
| SCHEMBL3783170 | 0.66 | ELANE (0.39) | TSHRALDH1A1PTGER1CYP1A2MAPT | |
| SCHEMBL28513666 | 0.65 | KDM4E (0.47) | TSHRHTR2CSLC6A4HTR2AALDH1A1 | |
| SCHEMBL12062174 | 0.65 | KDM4E (0.47) | TSHRHTR2CSLC6A4ALDH1A1L3MBTL1 | |
| SCHEMBL14415473 | 0.65 | AURKA (0.47) | TSHRALDH1A1TDP1L3MBTL1RAB9A | |
| SCHEMBL14348149 | 0.65 | TSHR (0.44) | TSHRALDH1A1PTGER1MAPTTDP1 | |
| SCHEMBL12359857 | 0.65 | TSHR (0.44) | TSHRALDH1A1CYP1A2L3MBTL1MEN1 |
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 |