Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.70 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CDC25B | P30305 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | LIG1 | P18858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3843558 | 0.88 | AKR1C3 (0.81) | AKR1C3NR4A1KMT2AHPGDMAPT | |
| SCHEMBL3956232 | 0.88 | AKR1C3 (0.81) | AKR1C3NR4A1KMT2AHPGDMAPT | |
| Hydrochloric Acid SCHEMBL8173202 | 0.85 | AKR1C3 (0.53) | AKR1C3NR4A1KMT2AHPGDMAPT | |
| SCHEMBL78316 | 0.84 | AKR1C3 (0.68) | AKR1C3NR4A1MAPTCDC25BATM | |
| SCHEMBL31672209 | 0.84 | AKR1C3 (0.68) | AKR1C3NR4A1MAPTCDC25BATM | |
| SCHEMBL1828088 | 0.82 | AKR1C3 (1.00) | AKR1C3NR4A1KMT2AMAPTPOLB | |
| SCHEMBL6299251 | 0.82 | NR4A1 (0.72) | AKR1C3NR4A1KMT2AMAPTMAPK1 | |
| SCHEMBL5754387 | 0.81 | AKR1C3 (0.65) | AKR1C3NR4A1KMT2AHPGDMAPT | |
| SCHEMBL7849291 | 0.81 | AKR1C3 (0.70) | AKR1C3NR4A1KMT2AHPGDMAPT | |
| SCHEMBL29875241 | 0.81 | AKR1C3 (0.65) | AKR1C3NR4A1KMT2AHPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-20150357578-A1 | ANTIAROMATIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES COMPRISING THE SAME | INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) | 2015-12-10 | — | — | US | disclosed |
| US-20150357578-A1 | ANTIAROMATIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES COMPRISING THE SAME | INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) | 2015-12-10 | — | — | US | disclosed |
| US-5117057-A | Insecticidal N' substituted-N-N'-disubstituted-hydrazines | ROHM AND HAAS COMPANY (US) | 1992-05-26 | — | — | US | disclosed |