Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7282690 | 0.93 | ALDH1A1 (0.36) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL7275916 | 0.93 | ALDH1A1 (0.36) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL7284030 | 0.87 | ALDH1A1 (0.39) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL7282388 | 0.87 | ALDH1A1 (0.39) | ALDH1A1TSHRSMN1; SMN2KCNH2PTGER4 | |
| SCHEMBL7274653 | 0.84 | ITGB3 (0.40) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL7284963 | 0.84 | MDM2 (0.34) | MDM2TP53 | |
| SCHEMBL7283079 | 0.84 | MDM2 (0.34) | MDM2TP53 | |
| SCHEMBL7275019 | 0.83 | ITGB3 (0.40) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL7275515 | 0.82 | ALDH1A1 (0.38) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL7283239 | 0.82 | DRD2 (0.39) | ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5591769-A | PYRROLIDINE DERIVATIVES; ANTICOAGULANTS | KARL THOMAE GMBH (DE) | 1997-01-07 | — | — | US | disclosed |
| US-5541343-A | ANTIAGGLOMERANTS FOR CELLS OR ANTICOAGULANTS | KARL THOMAE GMBH (DE) | 1996-07-30 | — | — | US | disclosed |
| EP-0483667-A2 | Cyclic imino derivatives, process for their preparation and drugs containing them | Dr. Karl Thomae GmbH (DE) | 1992-05-06 | — | — | EP | disclosed |