Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7496340 | 0.83 | HTR2A (0.53) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL11392849 | 0.80 | HTR2A (0.50) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL7954477 | 0.80 | TSHR (0.43) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL13144363 | 0.78 | TSHR (0.53) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL8062101 | 0.78 | TSHR (0.48) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL5269344 | 0.78 | THRA (0.39) | TSHRGLASMN1; SMN2LMNAMEN1 | |
| SCHEMBL11385203 | 0.77 | TSHR (0.41) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL5871572 | 0.77 | TSHR (0.52) | TSHRHTR2AHTR2CHTR2BGLA | |
| SCHEMBL2558627 | 0.77 | CALM1 (0.49) | TSHRGAASMN1; SMN2LMNAMEN1 | |
| Bromide SCHEMBL5608257 | 0.77 | TSHR (0.47) | TSHRHTR2AHTR2CHTR2BGLA |
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 |
|---|---|---|---|---|---|---|---|
| US-6818643-B1 | 3,9-DIAZABICYCLO(3.3.1)NONAN-2-ONE DERIVATIVES; PEPTIDYL-PROLYL ISOMERASE (PPIASE OR ROTAMASE) INHIBITORS; NEUROPROTECTIVE AGENTS | BRISTOL-MYERS SQUIBB COMPANY | 2004-11-16 | — | — | US | disclosed |