Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8979200 | 0.92 | MEN1 (0.42) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| SCHEMBL8646301 | 0.82 | PTPRB (0.30) | MEN1KMT2A | |
| SCHEMBL1483835 | 0.78 | CYP4F2 (0.37) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| SCHEMBL8090825 | 0.75 | CYP4F2 (0.36) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| SCHEMBL723018 | 0.75 | MEN1 (0.57) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| SCHEMBL7514889 | 0.74 | MEN1 (0.56) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| Ethyl Acetate SCHEMBL28034978 | 0.73 | ALDH1A1 (0.54) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| SCHEMBL49063 | 0.73 | CYP1A2 (0.52) | KMT2ACYP4F2CYP4A11L3MBTL1ALDH1A1 | |
| SCHEMBL7516322 | 0.72 | MEN1 (0.59) | MEN1KMT2ACYP4F2CYP4A11PKM | |
| SCHEMBL8216269 | 0.72 | MEN1 (0.59) | MEN1KMT2ACYP4F2CYP4A11PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0683154-B1 | Diisocyanates, process for their preparation and their use | BAYER AG (DE) | 1998-08-19 | — | — | EP | disclosed |
| US-5552507-A | DI-(3-ISOCYANATOPROPYL) MALONIC ACID DIESTERS, MONOMERS FOR POLYURETHANES OR POLYUREAS THAT ARE PHOTOSTABLE AND WEATHER RESISTANT | BAYER AKTIENGESELLSCHAFT (DE) | 1996-09-03 | — | — | US | disclosed |
| EP-0683154-A1 | Diisocyanates, process for their preparation and their use | BAYER AG (DE) | 1995-11-22 | — | — | EP | disclosed |