Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | HPGD | P15428 | 6/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL22356176 | 0.82 | NOS2 (0.44) | ALDH1A1HPGDNPSR1TSHRNOS2 | |
| SCHEMBL22356162 | 0.82 | NOS2 (0.44) | ALDH1A1HPGDNPSR1TSHRNOS2 | |
| SCHEMBL1813924 | 0.82 | HPGD (0.50) | ALDH1A1HPGDNPSR1TSHRKDM4E | |
| SCHEMBL8627456 | 0.82 | HPGD (0.50) | ALDH1A1HPGDNPSR1TSHRKDM4E | |
| SCHEMBL8626242 | 0.82 | HPGD (0.50) | ALDH1A1HPGDNPSR1TSHRKDM4E | |
| SCHEMBL5384353 | 0.82 | ALDH1A1 (0.42) | ALDH1A1HPGDNPSR1TSHRNOS2 | |
| SCHEMBL22480301 | 0.81 | ALDH1A1 (0.41) | ALDH1A1HPGDNPSR1TSHRNOS2 | |
| SCHEMBL9484981 | 0.79 | NOS2 (0.41) | ALDH1A1HPGDNPSR1TSHRNOS2 | |
| SCHEMBL1319534 | 0.79 | LMNA (0.60) | ALDH1A1NPSR1LMNAPOLBNPC1 | |
| SCHEMBL17361182 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HPGDNPSR1TSHRKDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023109775-A1 | PYRIMIDINE-ANNULATED TRIAZOLE DERIVATIVES AND THEIR USE IN PLATELET AGGREGATION INHIBITION | BEIJING HONGHUI MEDITECH CO., LTD (CN) | 2023-06-22 | — | — | WO | claimed |
| WO-2023109775-A1 | PYRIMIDINE-ANNULATED TRIAZOLE DERIVATIVES AND THEIR USE IN PLATELET AGGREGATION INHIBITION | BEIJING HONGHUI MEDITECH CO., LTD (CN) | 2023-06-22 | — | — | WO | disclosed |
| EP-3645516-A1 | HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS | Janssen Pharmaceutica NV (BE) | 2020-05-06 | — | — | EP | disclosed |
| WO-2019001420-A1 | HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS | JANSSEN PHARMACEUTICA NV (BE) | 2019-01-03 | — | — | WO | disclosed |
| CN-105517574-A | Combinations of hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2016-04-20 | — | — | CN | disclosed |