Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRDT | Q58F21 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | XBP1 | P17861 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18990217 | 0.85 | GAA (0.49) | SMN1; SMN2TP53GAATSHRMAPT | |
| SCHEMBL8648438 | 0.80 | RXFP1 (0.46) | POLBSMN1; SMN2TP53GAATSHR | |
| SCHEMBL28043739 | 0.80 | ALDH1A1 (0.54) | POLBSMN1; SMN2TP53GAATSHR | |
| SCHEMBL28043736 | 0.79 | DHFR (0.41) | BRDTPOLBSMN1; SMN2TP53GAA | |
| SCHEMBL28043741 | 0.78 | KMT2A (0.50) | POLBSMN1; SMN2TP53GAATSHR | |
| SCHEMBL8645108 | 0.75 | RXFP1 (0.65) | POLBSMN1; SMN2TSHRKDM4EALDH1A1 | |
| SCHEMBL18990995 | 0.74 | MAPT (0.49) | SMN1; SMN2TP53GAATSHRMAPT | |
| SCHEMBL28043744 | 0.74 | CYP1A2 (0.52) | POLBSMN1; SMN2TP53GAATSHR | |
| SCHEMBL28043745 | 0.74 | KMT2A (0.46) | POLBSMN1; SMN2TP53GAATSHR | |
| SCHEMBL15923525 | 0.74 | GAA (0.47) | POLBSMN1; SMN2TP53GAATSHR |
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-102807568-B | Thiadiazoles derivative class DPP-IV inhibitor | CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) | 2015-11-25 | — | — | CN | disclosed |