Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28477612 | 0.81 | TFPI2 (0.47) | KMT2AMEN1ELANEALDH1A1KDM4E | |
| SCHEMBL26170754 | 0.81 | HTT (0.53) | KMT2AMEN1HTTALDH1A1KDM4E | |
| SCHEMBL28558504 | 0.80 | L3MBTL1 (0.57) | KMT2AMEN1L3MBTL1 | |
| SCHEMBL19358619 | 0.77 | HTR2A (0.55) | ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL28576106 | 0.75 | KMT2A (0.57) | KMT2AMEN1ALDH1A1KDM4ETHRB | |
| SCHEMBL30788389 | 0.73 | P2RX4 (0.54) | KMT2AALDH1A1LMNASMN1; SMN2POLB | |
| SCHEMBL21062764 | 0.73 | P2RX4 (0.54) | KMT2AALDH1A1LMNASMN1; SMN2POLB | |
| SCHEMBL6946329 | 0.73 | L3MBTL1 (0.43) | KMT2AMEN1ELANEALDH1A1KDM4E | |
| SCHEMBL26134474 | 0.73 | OXER1 (0.54) | KMT2AMEN1ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL30936109 | 0.72 | HTR6 (0.54) | — |
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 |
|---|---|---|---|---|---|---|---|
| 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 |