Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | ALB | P02768 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6326755 | 0.88 | PTGS2 (0.51) | TSHRAKR1C3TDP1RAB9AMAPK1 | |
| SCHEMBL12157463 | 0.80 | TSHR (0.73) | TSHRRECQLALDH1A1AKR1C3RAB9A | |
| SCHEMBL6250250 | 0.78 | ALDH1A1 (0.52) | ALDH1A1AKR1C3SMN1; SMN2GAAHSD17B10 | |
| SCHEMBL6250244 | 0.78 | ALDH1A1 (0.52) | ALDH1A1AKR1C3SMN1; SMN2GAAHSD17B10 | |
| Methylphenylsulfone SCHEMBL13270292 | 0.74 | AKR1C3 (0.58) | TSHRRECQLALDH1A1AKR1C3RAB9A | |
| Morpholine SCHEMBL9436743 | 0.69 | MAPT (0.46) | TSHRRECQLALDH1A1AKR1C3TDP1 | |
| SCHEMBL11711031 | 0.68 | RAB9A (0.54) | TSHRALDH1A1AKR1C3NPC1RAB9A | |
| SCHEMBL8386522 | 0.68 | PHGDH (0.70) | TSHRALDH1A1AKR1C3NPC1RAB9A | |
| SCHEMBL5264773 | 0.68 | ALDH1A1 (0.59) | ALDH1A1TDP1SMN1; SMN2GAAHSD17B10 | |
| SCHEMBL13800995 | 0.67 | TSHR (0.65) | TSHRRAB9AKMT2APOLBSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0882015-B1 | DIPHENYL STILBENES AS PRODRUGS TO COX-2 INHIBITORS | MERCK FROSST CANADA INC (CA) | 2000-12-27 | — | — | EP | claimed |
| EP-0882015-A1 | DIPHENYL STILBENES AS PRODRUGS TO COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1998-12-09 | — | — | EP | claimed |
| US-5733909-A | ANTIINFLAMMATORY AGENTS; ANALGESICS; ANTIPYRETIC AGENT | MERCK FROSST CANADA, INC. (CA) | 1998-03-31 | — | — | US | claimed |
| WO-1997028120-A1 | DIPHENYL STILBENES AS PRODRUGS TO COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1997-08-07 | — | — | WO | claimed |
| EP-0882015-B1 | DIPHENYL STILBENES AS PRODRUGS TO COX-2 INHIBITORS | MERCK FROSST CANADA INC (CA) | 2000-12-27 | — | — | EP | disclosed |