Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADCY1 | Q08828 | 8/20 | 0.54 |
| ▸ | LMNA | P02545 | 7/20 | 0.53 |
| ▸ | TP53 | P04637 | 4/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.45 |
| ▸ | CCR6 | P51684 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22594340 | 0.88 | KDM4E (0.65) | ADCY1LMNATP53POLBKDM4E | |
| SCHEMBL22589868 | 0.86 | KCNK2 (0.47) | ADCY1LMNAKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL22589718 | 0.82 | ADCY1 (0.78) | ADCY1LMNATP53POLBKDM4E | |
| SCHEMBL29848547 | 0.77 | KDM4E (0.76) | ADCY1LMNATP53POLBKDM4E | |
| SCHEMBL22594337 | 0.76 | ADCY1 (0.57) | ADCY1LMNAKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL22594293 | 0.75 | LMNA (0.64) | ADCY1LMNATP53POLBKDM4E | |
| SCHEMBL22589774 | 0.74 | KDM4E (0.58) | ADCY1LMNATP53KDM4ESMN1; SMN2 | |
| SCHEMBL17717062 | 0.74 | KDM4E (0.68) | ADCY1LMNATP53KDM4ESMN1; SMN2 | |
| SCHEMBL22594290 | 0.74 | LMNA (0.61) | ADCY1LMNATP53POLBKDM4E | |
| SCHEMBL22594291 | 0.74 | ADCY1 (0.56) | ADCY1LMNATP53POLBKDM4E |
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-2020219792-A1 | CF3-, OCF3-, SCF3- AND SF5-CONTAINING ANTIBACTERIAL AGENTS | PURDUE RESEARCH FOUNDATION (US) | 2020-10-29 | — | — | WO | disclosed |