Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 8/20 | 0.39 |
| ▸ | PTGDR | Q13258 | 5/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL15818896 | 0.81 | CYP2A6 (0.43) | KDM4CTAAR1PTGDR2PTGDRCHRNB2 | |
| SCHEMBL22719380 | 0.77 | HTR1A (0.39) | PTGDR2CHRNB2CHRNA4IDO1OPRL1 | |
| SCHEMBL29453786 | 0.77 | HTR1A (0.39) | PTGDR2CHRNB2CHRNA4IDO1OPRL1 | |
| SCHEMBL1155817 | 0.77 | KDM4C (0.48) | KDM4CTAAR1PTGDR2PTGDRPTGER2 | |
| SCHEMBL3781719 | 0.74 | CHRNB2 (0.61) | TAAR1PTGDR2PTGDRCHRNB2CHRNA4 | |
| SCHEMBL16291407 | 0.74 | TAAR1 (0.42) | TAAR1PTGDR2PTGDRCHRNB2CHRNA4 | |
| SCHEMBL30997823 | 0.73 | TP53 (0.46) | TAAR1PTGDR2PTGDRCHRNB2CHRNA4 | |
| SCHEMBL9911450 | 0.73 | TP53 (0.46) | TAAR1PTGDR2PTGDRCHRNB2CHRNA4 | |
| SCHEMBL30089455 | 0.72 | IDO1 (0.44) | IDO1MEN1KMT2A | |
| SCHEMBL384040 | 0.72 | IDO1 (0.44) | IDO1MEN1KMT2A |
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-118791436-A | 2-Aminopyrimidine derivative and preparation method and application thereof | 中国科学院上海药物研究所 | 2024-10-18 | — | — | CN | disclosed |