Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.59 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | CASP3 | P42574 | 2/20 | 0.59 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.59 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.59 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | TNF | P01375 | 1/20 | 0.48 |
| ▸ | IL6 | P05231 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TDP2 | O95551 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | CASP9 | P55211 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28817971 | 0.86 | TNF (0.45) | MAPTRAB9ANPC1CASP3SENP8 | |
| SCHEMBL28005646 | 0.83 | MEN1 (0.56) | MAPTRAB9ANPC1KDM4ETNF | |
| SCHEMBL2454936 | 0.82 | RAB9A (0.72) | MAPTRAB9ANPC1CASP3SENP8 | |
| SCHEMBL2454938 | 0.82 | RAB9A (0.72) | MAPTRAB9ANPC1CASP3SENP8 | |
| SCHEMBL28005306 | 0.79 | ALDH1A1 (0.46) | MAPTRAB9ANPC1SMN1; SMN2PTGS2 | |
| SCHEMBL28158113 | 0.79 | CYP1A2 (0.68) | MAPTRAB9ANPC1SMN1; SMN2TNF | |
| SCHEMBL28005301 | 0.78 | SMN1; SMN2 (0.50) | MAPTRAB9ANPC1CASP3SENP8 | |
| SCHEMBL9619547 | 0.77 | CYP1A2 (0.69) | MAPTRAB9ANPC1CASP3SENP8 | |
| SCHEMBL30969584 | 0.75 | MAPT (0.59) | MAPTRAB9ANPC1KDM4ESMN1; SMN2 | |
| SCHEMBL28005275 | 0.74 | NFE2L2 (0.65) | MAPTRAB9ANPC1KDM4ESMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104592032-A | Asymmetric mono-carbonyl curcumin analogues having 2-nitro unilateral substitute and application of analogues | UNIV WENZHOU MEDICAL | 2015-05-06 | — | — | CN | disclosed |