Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19741330 | 0.79 | KMT2A (0.44) | EPHX1ALDH1A1CYP3A4RAB9ASMN1; SMN2 | |
| SCHEMBL5452912 | 0.79 | ALDH1A1 (0.51) | EPHX1ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL19741335 | 0.77 | SIGMAR1 (0.42) | EPHX1ALDH1A1CYP3A4RAB9ASMN1; SMN2 | |
| SCHEMBL17982706 | 0.76 | EPHX1 (0.43) | EPHX1ALDH1A1EPHX2SIGMAR1 | |
| SCHEMBL17956788 | 0.74 | EPHX1 (0.45) | EPHX1ALDH1A1EPHX2SIGMAR1 | |
| SCHEMBL3483201 | 0.73 | ALDH1A1 (0.46) | EPHX1ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL17956777 | 0.72 | SIGMAR1 (0.45) | EPHX1ALDH1A1CYP3A4RAB9ASMN1; SMN2 | |
| SCHEMBL17956791 | 0.71 | ALDH1A1 (0.37) | EPHX1ALDH1A1CYP3A4RAB9ASMN1; SMN2 | |
| SCHEMBL3482996 | 0.71 | SMN1; SMN2 (0.46) | EPHX1ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL16648408 | 0.70 | EPHX1 (0.51) | EPHX1ALDH1A1CYP3A4CYP1A2CYP2C9 |
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-10767112-B2 | Methods of producing metal sulfides, metal selenides, and metal sulfides/selenides having controlled architectures using kinetic control | THE TRUSTEES OF THE COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2020-09-08 | — | — | US | disclosed |
| US-20170369779-A1 | METHODS OF PRODUCING METAL SULFIDES, METAL SELENIDES, AND METAL SULFIDES/SELENIDES HAVING CONTROLLED ARCHITECTURES USING KINETIC CONTROL | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2017-12-28 | — | — | US | disclosed |