Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 13/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 12/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.33 |
| ▸ | CHRNG | P07510 | 1/20 | 0.33 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CHRND | Q07001 | 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 | |
|---|---|---|---|---|
| SCHEMBL4022762 | 0.86 | GABRA1 (0.39) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL27352441 | 0.77 | VCAM1 (0.44) | TSHRALDH1A1HSD17B10TDP1NPC1 | |
| SCHEMBL4028700 | 0.76 | EPHX2 (0.47) | HSD17B10SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL27740026 | 0.76 | ALDH1A1 (0.51) | TSHRALDH1A1HSD17B10TDP1NPC1 | |
| SCHEMBL11126724 | 0.72 | TSHR (0.80) | TSHRALDH1A1HSD17B10TDP1MAPK1 | |
| SCHEMBL19452379 | 0.71 | ALDH1A1 (0.67) | TSHRALDH1A1HSD17B10TDP1NPC1 | |
| SCHEMBL8738720 | 0.71 | GABRA1 (0.43) | — | |
| SCHEMBL19387958 | 0.70 | RORC (0.47) | ALDH1A1HSD17B10TDP1NPC1POLB | |
| SCHEMBL6376548 | 0.69 | ALOX15 (0.45) | TSHRALDH1A1HSD17B10SLC6A4SLC6A2 | |
| SCHEMBL4024746 | 0.69 | SMN1; SMN2 (0.47) | ALDH1A1TDP1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1117569-C | Bicyclic fibrinogen antagonists | SMITHKLINE BEECHAM CORP (US) | 2003-08-13 | — | — | CN | disclosed |
| CN-1143323-A | Bicyclic fibrinogen antagonists | SMITHKLINE BEECHAM CORP (US) | 1997-02-19 | — | — | CN | disclosed |