Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 7/20 | 0.47 |
| ▸ | MAOB | P27338 | 7/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8674540 | 0.82 | MAOB (0.71) | KDM4EALDH1A1MAOAMAOBNPC1 | |
| SCHEMBL7321393 | 0.81 | KDM4E (0.55) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 | |
| SCHEMBL6181647 | 0.81 | CHRM2 (0.59) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 | |
| SCHEMBL8670249 | 0.81 | MAOA (0.45) | KDM4EALDH1A1MAOAMAOBCYP3A4 | |
| SCHEMBL493931 | 0.79 | MAOA (0.62) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 | |
| SCHEMBL29432706 | 0.79 | MAOA (0.62) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 | |
| SCHEMBL8671069 | 0.78 | TLR4 (0.54) | MAOAMAOB | |
| SCHEMBL5247739 | 0.78 | KDM4E (0.60) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 | |
| SCHEMBL28886740 | 0.78 | TP53 (0.53) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 | |
| Benzene SCHEMBL27795602 | 0.77 | MAOA (0.65) | SMN1; SMN2KDM4EALDH1A1CHRM2CHRM1 |
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-5811422-A | USEFUL FOR TREATING VIRAL INFECTIONS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-09-22 | — | — | US | disclosed |
| US-5610294-A | VIRAL TREATMENT | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-03-11 | — | — | US | disclosed |