Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28141803 | 0.83 | DHFR (0.44) | P2RX3P2RX2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3844233 | 0.79 | NPC1 (0.32) | P2RX3P2RX2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL28332979 | 0.76 | HTT (0.41) | P2RX3P2RX2POLBHTTKDM4E | |
| SCHEMBL18620550 | 0.75 | NOS2 (0.42) | ALDH1A1POLBHTTDHFR | |
| SCHEMBL9537122 | 0.74 | DHFR (0.43) | ALDH1A1HTTDHFR | |
| SCHEMBL12113956 | 0.74 | POLB (0.44) | ALDH1A1LMNASMN1; SMN2POLBHTT | |
| SCHEMBL21425714 | 0.74 | KDM4E (0.42) | ALDH1A1LMNASMN1; SMN2POLBHTT | |
| SCHEMBL31569481 | 0.74 | POLB (0.44) | ALDH1A1LMNASMN1; SMN2POLBHTT | |
| SCHEMBL9536206 | 0.72 | TXNRD1 (0.37) | ALDH1A1LMNASMN1; SMN2POLBHTT | |
| SCHEMBL9536859 | 0.72 | ADORA2A (0.46) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A |
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-110294751-B | Imidazo [4,5-b ] pyridine compound with biological activity and preparation method and application thereof | 湖南化工研究院有限公司 | 2020-11-20 | — | — | CN | disclosed |
| CN-110294751-A | Have the imidazoles [4,5-b] of bioactivity and pyridine compounds and their and its preparation method and application | 湖南化工研究院有限公司 | 2019-10-01 | — | — | CN | disclosed |