Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.65 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | PKLR | P30613 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | BRD4 | O60885 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 1/20 | 0.50 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | PNMT | P11086 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6984820 | 0.86 | HTR6 (0.61) | PKMSMN1; SMN2LMNAKMT2ABRD4 | |
| SCHEMBL31681377 | 0.84 | EIF2AK2 (0.54) | PKMNLRP3SMN1; SMN2LMNABRD4 | |
| SCHEMBL2229992 | 0.84 | HTR2C (0.61) | PKMSMN1; SMN2KMT2ABRD4CA12 | |
| SCHEMBL1009369 | 0.82 | PLAU (0.49) | PKMSMN1; SMN2LMNAKMT2ACA12 | |
| SCHEMBL6985319 | 0.81 | CA12 (0.53) | PKMSMN1; SMN2LMNACA12CA1 | |
| SCHEMBL6986758 | 0.81 | PKM (0.56) | PKMSMN1; SMN2LMNAKMT2ABRD4 | |
| SCHEMBL6985107 | 0.81 | LMNA (0.67) | PKMSMN1; SMN2LMNABRD4CA12 | |
| SCHEMBL6982218 | 0.81 | PKM (0.56) | PKMSMN1; SMN2LMNAPKLRKMT2A | |
| SCHEMBL6983859 | 0.81 | PKM (0.56) | PKMLMNABRD4PGRMAPT | |
| SCHEMBL6974134 | 0.81 | HSD17B2 (0.50) | PKMSMN1; SMN2LMNABRD4CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| US-6300342-B1 | FOR THERAPY OR INHIBITING THROMBUS FORMATION; FOR THERAPY OF FIBRIN-DEPENDENT INFLAMMATORY CONDITION | BOEHRINGER INGELHEIM PHARM KG (DE) | 2001-10-09 | — | — | US | disclosed |