Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB2 | P30411 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3731371 | 0.86 | BDKRB2 (0.51) | BDKRB2TDP1CYP1A2KDM4ECYP3A4 | |
| SCHEMBL3723663 | 0.86 | BDKRB2 (0.51) | BDKRB2TDP1CYP1A2KDM4ECYP3A4 | |
| SCHEMBL27898395 | 0.86 | TDP1 (0.49) | TDP1CYP1A2 | |
| SCHEMBL15301082 | 0.82 | BDKRB2 (0.47) | BDKRB2CYP1A2KDM4ECYP3A4CYP2A6 | |
| SCHEMBL6656944 | 0.82 | BDKRB2 (0.47) | BDKRB2CYP1A2KDM4ECYP3A4CYP2A6 | |
| SCHEMBL28033421 | 0.79 | BDKRB2 (0.38) | BDKRB2 | |
| SCHEMBL7784141 | 0.78 | LTA4H (0.42) | BDKRB2TDP1CYP3A4 | |
| SCHEMBL153634 | 0.77 | BDKRB2 (0.48) | BDKRB2TDP1KDM4ELMNACYP3A4 | |
| SCHEMBL11246667 | 0.76 | CYP1A2 (0.58) | AKR1C3AKR1C2PTGS1SLC2A1RAD52 | |
| SCHEMBL8683396 | 0.75 | AKR1C3 (0.53) | AKR1C3AKR1C2PTGS1SLC2A1RAD52 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104956508-B | Solution process organic semiconducting materials and organic semiconductor equipment | 日本化药株式会社 | 2017-07-21 | — | — | CN | disclosed |
| CN-104956508-A | ORGANIC SEMICONDUCTOR MATERIAL FOR SOLUTION PROCESS AND ORGANIC SEMICONDUCTOR DEVICE | NIPPON KAYAKU KK | 2015-09-30 | — | — | CN | disclosed |