Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6299735 | 0.80 | KIF11 (0.81) | KIF11CYP2A6MEN1MAPTAHR | |
| Benzene SCHEMBL28184721 | 0.76 | KIF11 (0.81) | KIF11CYP2A6MEN1MAPTAHR | |
| SCHEMBL28184723 | 0.74 | KIF11 (0.56) | KIF11CYP2A6MEN1MAPTAHR | |
| SCHEMBL21563916 | 0.73 | STING1 (0.53) | CYP2A6ROCK2MEN1MAPTKMT2A | |
| SCHEMBL11781048 | 0.72 | KIF11 (0.42) | KIF11CYP2A6CHEK1MEN1MAPT | |
| SCHEMBL29823607 | 0.72 | KIF11 (1.00) | KIF11CYP2A6MEN1MAPTAHR | |
| SCHEMBL8689823 | 0.72 | KIF11 (0.68) | KIF11CYP2A6MEN1MAPTAHR | |
| SCHEMBL2775335 | 0.72 | KIF11 (1.00) | KIF11CYP2A6MEN1MAPTAHR | |
| SCHEMBL27865132 | 0.71 | SRC (0.58) | KIF11CYP2A6PIM1PIM3ALDH1A1 | |
| SCHEMBL28106992 | 0.71 | KIF11 (0.53) | KIF11CYP2A6MEN1MAPTAHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1327632-A1 | METHOD FOR PRODUCING TRIMER OF INDOLE DERIVATIVE, AND TRIMER OF INDOLE DERIVATIVE AND LAMINATED STRUCTURE THEREOF | Mitsubishi Rayon Co., Ltd. (JP) | 2003-07-16 | — | — | EP | disclosed |