Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.54 |
| ▸ | ACHE | P22303 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | MAOA | P21397 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | MGAM | O43451 | 1/20 | 0.54 |
| ▸ | SI | P14410 | 1/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 11/20 | 0.49 |
| ▸ | CA12 | O43570 | 10/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6544707 | 0.83 | CA12 (0.56) | KDM4EHSD17B10ACHECYP3A4MAOA | |
| SCHEMBL18788615 | 0.80 | ACHE (0.55) | KDM4EHSD17B10ACHECYP3A4MAOA | |
| SCHEMBL7826982 | 0.79 | KDM4E (0.50) | KDM4EHSD17B10ACHECYP3A4MAOA | |
| SCHEMBL11706351 | 0.74 | LOXL2 (0.46) | PTPN1SMN1; SMN2L3MBTL1 | |
| SCHEMBL11712601 | 0.74 | MAOB (0.41) | KDM4EMAOACYP2A6ALDH1A1MAPT | |
| SCHEMBL11194490 | 0.73 | GAA (0.64) | KDM4EHSD17B10ACHECYP3A4MAOA | |
| SCHEMBL2978737 | 0.73 | CA12 (0.62) | KDM4EHSD17B10MAOAGAANPC1 | |
| SCHEMBL3663606 | 0.71 | CA12 (0.69) | KDM4EHSD17B10ACHECYP3A4CYP2D6 | |
| SCHEMBL10205474 | 0.71 | SRD5A1 (0.66) | KDM4EHSD17B10ACHECYP3A4MAOA | |
| SCHEMBL10205466 | 0.71 | ALDH1A1 (0.50) | KDM4EHSD17B10ACHECYP3A4MAOA |
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-6255324-B1 | MICROBIOCIDES; SKIN DISORDERS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2001-07-03 | — | — | US | disclosed |