Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL473100 | 0.94 | P2RX7 (0.59) | P2RX7GAAKDM4ETDP1SMN1; SMN2 | |
| SCHEMBL29290659 | 0.84 | SMN1; SMN2 (0.62) | P2RX7SMN1; SMN2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL13506223 | 0.80 | SMN1; SMN2 (0.68) | KDM4ESMN1; SMN2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL5923550 | 0.78 | P2RX7 (1.00) | P2RX7GAAKDM4ETDP1POLB | |
| O-Xylene SCHEMBL27872007 | 0.78 | ALDH1A1 (0.55) | KDM4ETDP1SMN1; SMN2ALDH1A1LMNA | |
| O-Xylene SCHEMBL27872003 | 0.78 | ALDH1A1 (0.55) | KDM4ETDP1SMN1; SMN2ALDH1A1LMNA | |
| O-Xylene SCHEMBL27872109 | 0.78 | ALDH1A1 (0.55) | KDM4ETDP1SMN1; SMN2ALDH1A1LMNA | |
| O-Xylene SCHEMBL27872009 | 0.78 | ALDH1A1 (0.55) | KDM4ETDP1SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL1952787 | 0.78 | NLRP3 (0.63) | TDP1SMN1; SMN2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL2234416 | 0.78 | GAA (0.59) | GAAKDM4ETDP1SMN1; SMN2CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2412703-B1 | URETHANE COMPOUND AND PROCESS FOR PRODUCTION THEREOF, AND ISOCYANATE AND PROCESS FOR PRODUCTION THEREOF | MITSUI CHEMICALS INC (JP) | 2016-06-29 | — | — | EP | disclosed |
| US-9150502-B2 | Urethane compound and method for producing the same, and isocyanate and method for producing the same | MITSUI CHEMICALS, INC. (JP) | 2015-10-06 | — | — | US | disclosed |
| EP-2412703-A1 | URETHANE COMPOUND AND PROCESS FOR PRODUCTION THEREOF, AND ISOCYANATE AND PROCESS FOR PRODUCTION THEREOF | Mitsui Chemicals, Inc. (JP) | 2012-02-01 | — | — | EP | disclosed |
| US-20120010427-A1 | URETHANE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ISOCYANATE AND METHOD FOR PRODUCING THE SAME | MITSUI CHEMICALS, INC. | 2012-01-12 | — | — | US | disclosed |