Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 4/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8696712 | 0.87 | ESR1 (0.45) | SMN1; SMN2CTDSP1MAPK1TSHRMEN1 | |
| SCHEMBL8637224 | 0.83 | POLB (0.38) | SMN1; SMN2LMNACTDSP1TSHRPKM | |
| SCHEMBL8634739 | 0.69 | CA12 (0.41) | LMNAMEN1KMT2AMAPTGAA | |
| SCHEMBL8697322 | 0.66 | MAPT (0.36) | SMN1; SMN2LMNAMAPTGAAKDM4E | |
| SCHEMBL8634709 | 0.64 | CYP1A2 (0.36) | SMN1; SMN2MAPK1TSHRMAPTGAA | |
| SCHEMBL20036118 | 0.64 | PKM (0.51) | SMN1; SMN2LMNAMAPK1TSHRPKM | |
| SCHEMBL27350346 | 0.64 | MAPT (0.55) | LMNAMAPK1MEN1KMT2AMAPT | |
| SCHEMBL11673375 | 0.62 | CHKA (0.63) | SMN1; SMN2LMNATSHRMEN1ALOX15 | |
| SCHEMBL18590696 | 0.62 | CHKA (0.67) | SMN1; SMN2LMNAMAPTGAAKDM4E | |
| SCHEMBL7956272 | 0.61 | NPC1 (0.69) | SMN1; SMN2TSHRMEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5753659-A | ANTICOAGULANTS FOR BLOOD DISORDER, CARDIOVASCULAR DISORDER, THROMBOSIS, | ZENECA LIMITED (GB) | 1998-05-19 | — | — | US | disclosed |
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |