Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | SCN1A | P35498 | 2/20 | 0.58 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.58 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.58 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | MMP1 | P03956 | 1/20 | 0.56 |
| ▸ | MMP2 | P08253 | 1/20 | 0.56 |
| ▸ | MMP9 | P14780 | 1/20 | 0.56 |
| ▸ | MMP8 | P22894 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7898705 | 0.99 | ALDH1A1 (0.60) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL25166782 | 0.99 | ALDH1A1 (0.60) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL7007500 | 0.99 | ALDH1A1 (0.60) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| Hydrochloric Acid SCHEMBL6792141 | 0.97 | SCN1A (0.61) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL12720636 | 0.95 | KMT2A (0.63) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL8342506 | 0.95 | KMT2A (0.56) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL31284709 | 0.94 | KMT2A (0.68) | KMT2AMEN1ALDH1A1CYP19A1NPY5R | |
| SCHEMBL7523378 | 0.93 | NPY5R (0.55) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL8342508 | 0.93 | KMT2A (0.57) | KMT2AMEN1ALDH1A1SCN1ASCN2A | |
| SCHEMBL3540913 | 0.92 | KMT2A (0.66) | KMT2AMEN1ALDH1A1CYP19A1NPY5R |
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 |
|---|---|---|---|---|---|---|---|
| US-6191273-B1 | 3,6,10,14-SUBSTITUTED-3,6,10,16-TETRAAZABICYCLO(10.3.1)-HEXADE CA-1(16),12,14-TRIENE COMPOUNDS OF GIVEN FORMULA; ANTIBACTERIAL AND OTHER UTILITIES, SUCH AS TO SCREEN FOR PESTICIDES OR DRUGS | ISIS PHARMACEUTICALS, INC. | 2001-02-20 | — | — | US | disclosed |