Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | SCN1A | P35498 | 2/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13284004 | 0.79 | ALDH1A1 (0.60) | THRBTHRAKDM4ELMNAALDH1A1 | |
| SCHEMBL11660551 | 0.78 | ALDH1A1 (0.46) | KDM4ELMNAALDH1A1CYP1A2MEN1 | |
| SCHEMBL11191384 | 0.78 | GSTP1 (0.65) | THRBTHRAKDM4ELMNAALDH1A1 | |
| SCHEMBL9717524 | 0.75 | HPGD (0.44) | THRBTHRAKDM4ELMNAALDH1A1 | |
| SCHEMBL11715405 | 0.69 | KDM4E (0.52) | KDM4ELMNAALDH1A1MAOBCYP1A2 | |
| SCHEMBL8880873 | 0.68 | GSTP1 (0.62) | THRBTHRALMNAALDH1A1MEN1 | |
| SCHEMBL11194883 | 0.68 | GSTP1 (0.52) | THRBTHRAKDM4ELMNAALDH1A1 | |
| SCHEMBL7303821 | 0.68 | KDM4E (0.49) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7303826 | 0.67 | KDM4E (0.48) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| Hypochlorous Acid SCHEMBL9144744 | 0.67 | KDM4E (0.49) | KDM4ELMNAALDH1A1MAOBCYP1A2 |
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-4390537-A | ANTIALLERGENS | MERCK & CO., INC. (US) | 1983-06-28 | — | — | US | disclosed |
| US-4342782-A | PROCESS FOR TEATING ALLERGIES | MERCK & CO., INC. (US) | 1982-08-03 | — | — | US | disclosed |