Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.76 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | NAT1 | P18440 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.53 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.52 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.48 |
| ▸ | CTSD | P07339 | 2/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.47 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.47 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.47 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8536872 | 1.00 | PTGS2 (0.76) | PTGS2PTGS1NPC1NAT1MEN1 | |
| SCHEMBL7768284 | 0.87 | PTGS2 (1.00) | PTGS2PTGS1NPC1NAT1MEN1 | |
| SCHEMBL8309757 | 0.87 | PTGS2 (1.00) | PTGS2PTGS1NPC1NAT1MEN1 | |
| SCHEMBL8618544 | 0.87 | PTGS2 (1.00) | PTGS2PTGS1NPC1NAT1MEN1 | |
| SCHEMBL8535410 | 0.82 | PTGS2 (0.85) | PTGS2PTGS1NPC1NAT1MEN1 | |
| SCHEMBL8535412 | 0.82 | PTGS2 (0.85) | PTGS2PTGS1NPC1NAT1MEN1 | |
| SCHEMBL18103059 | 0.82 | CISD1 (0.76) | PTGS2NPC1NAT1MEN1ALDH1A1 | |
| SCHEMBL18095857 | 0.82 | CISD1 (0.76) | PTGS2NPC1NAT1MEN1ALDH1A1 | |
| SCHEMBL18095856 | 0.82 | CISD1 (0.76) | PTGS2NPC1NAT1MEN1ALDH1A1 | |
| SCHEMBL9474485 | 0.80 | PTGS2 (0.62) | PTGS2PTGS1NPC1NAT1MEN1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0434394-B1 | Compounds for treating inflammatory bowel disease | LILLY CO ELI (US) | 1998-08-05 | — | — | EP | disclosed |
| WO-1996022772-A1 | METHOD FOR TREATING MULTIPLE SCLEROSIS | ELI LILLY AND COMPANY (US) | 1996-08-01 | — | — | WO | disclosed |
| EP-0722729-A2 | Aryl-substituted rhodanines for treating multiple sclerosis | ELI LILLY AND COMPANY (US) | 1996-07-24 | — | — | EP | disclosed |
| US-5387690-A | Method of treating inflammatory bowel disease | ELI LILLY AND COMPANY (US) | 1995-02-07 | — | — | US | disclosed |
| US-5158966-A | Aryl-substituted rhodanine derivatives | THE UNIVERSITY OF COLORADO FOUNDATION, INC. (US) | 1992-10-27 | — | — | US | disclosed |
| EP-0500337-A1 | Composition containing aryl-substituted rhodanine derivatives for the treatment of type I diabetes | UNIVERSITY OF COLORADO FOUNDATION, INC. (US) | 1992-08-26 | — | — | EP | disclosed |
| EP-0434394-A2 | Compounds for treating inflammatory bowel disease | ELI LILLY AND COMPANY (US) | 1991-06-26 | — | — | EP | disclosed |