Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8213405 | 0.82 | TSHR (0.46) | ALDH1A1HTTTSHRMAPTVCAM1 | |
| SCHEMBL11812535 | 0.70 | ALDH1A1 (0.41) | ALDH1A1HTTTSHRMAPTKMT2A | |
| SCHEMBL18509677 | 0.68 | ALDH1A1 (0.41) | ALDH1A1KDM4EHTTHCAR3TSHR | |
| SCHEMBL11323967 | 0.67 | GPR35 (0.50) | ALDH1A1KDM4EHTTTSHRMAPT | |
| SCHEMBL1492448 | 0.66 | ALDH1A1 (0.55) | ALDH1A1HTTTSHRMAPTMAPK1 | |
| SCHEMBL4535995 | 0.66 | ALDH1A1 (0.54) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL8214082 | 0.64 | ALDH1A1 (0.44) | ALDH1A1KDM4ETSHRMAPTMAPK1 | |
| SCHEMBL29149356 | 0.64 | TPMT (0.40) | ALDH1A1KDM4EHTTTSHRMAPT | |
| SCHEMBL31347490 | 0.64 | ALDH1A1 (0.51) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL31009343 | 0.64 | TPMT (0.40) | ALDH1A1KDM4EHTTTSHRMAPT |
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-5585522-A | Amino substituted bishalomethyl benzene compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1996-12-17 | — | — | US | claimed |
| US-5585522-A | Amino substituted bishalomethyl benzene compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1996-12-17 | — | — | US | disclosed |