Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM6B | O15054 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.40 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3973189 | 0.86 | POLB (0.55) | ALOX15HTTFGFR1KDM4ECYP19A1 | |
| SCHEMBL31556376 | 0.86 | POLB (0.55) | ALOX15HTTFGFR1KDM4ECYP19A1 | |
| SCHEMBL2610310 | 0.83 | POLB (0.48) | FGFR1KDM4EMGLLROCK1POLB | |
| SCHEMBL3975054 | 0.81 | FGFR1 (0.60) | ALOX15HTTFGFR1KDM4EMGLL | |
| SCHEMBL31525708 | 0.80 | HTT (0.48) | ALOX15HTTFGFR1KDM4ECYP19A1 | |
| SCHEMBL31525861 | 0.80 | ALOX15 (0.47) | ALOX15HTTFGFR1KDM4ECYP19A1 | |
| SCHEMBL31525835 | 0.80 | ALDH1A1 (0.54) | ALOX15HTTFGFR1KDM4ECYP19A1 | |
| SCHEMBL958825 | 0.79 | ROCK1 (0.47) | ALOX15HTTFGFR1KDM4EJMJD6 | |
| SCHEMBL28312597 | 0.77 | RXRA (0.46) | ALOX15HTTFGFR1KDM4EPOLB | |
| SCHEMBL28674784 | 0.77 | MAPT (0.46) | ALOX15HTTFGFR1KDM4ECYP19A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112574180-B | N-2-pyrimidinyl-3-fluoroindole compound and preparation method and application thereof | 浙江工业大学 | 2021-10-15 | — | — | CN | disclosed |
| CN-112574180-A | N-2-pyrimidinyl-3-fluoroindole compound and preparation method and application thereof | 浙江工业大学 | 2021-03-30 | — | — | CN | disclosed |
| CN-106279236-B | Method for synthesizing 2-triisopropyl silicon-based acetylene indole compound | 南京理工大学 | 2020-04-10 | — | — | CN | disclosed |