Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | GLS | O94925 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL17539083 | 1.00 | KDM4E (0.56) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL17539087 | 0.92 | KDM4E (0.56) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL17509613 | 0.87 | HTR2C (0.37) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL17509606 | 0.78 | HTR2C (0.37) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL17539152 | 0.77 | NFKB1 (0.37) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL16153700 | 0.76 | MAPT (0.76) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL17539082 | 0.75 | GPR119 (0.41) | MCHR1GLSHTR2CSLC6A4 | |
| SCHEMBL17539116 | 0.75 | NFKB1 (0.37) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL6383092 | 0.73 | ALDH1A1 (0.70) | KDM4EMAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL19236010 | 0.71 | MCHR1 (0.39) | MCHR1GLSHTR2CSLC6A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016025681-A1 | INHIBITORS OF HIV-1 ENTRY AND METHODS OF USE THEREOF | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2016-02-18 | — | — | WO | disclosed |