Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | P2RX4 | Q99571 | 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 | |
|---|---|---|---|---|
| SCHEMBL6372301 | 0.76 | ATM (0.46) | ALDH1A1SMN1; SMN2TDP1CYP1A2TSHR | |
| SCHEMBL2183534 | 0.75 | P2RX4 (0.42) | ALDH1A1SMN1; SMN2TDP1CYP2C19ATM | |
| SCHEMBL11732900 | 0.74 | SMN1; SMN2 (0.48) | ALDH1A1SMN1; SMN2TDP1TSHRRET | |
| SCHEMBL8211547 | 0.71 | ATM (0.47) | ALDH1A1SMN1; SMN2TDP1TSHRATM | |
| SCHEMBL9110269 | 0.71 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2IDO1TSHRLMNA | |
| SCHEMBL7398001 | 0.71 | CYP1A2 (0.48) | ALDH1A1SMN1; SMN2IDO1CYP1A2TSHR | |
| SCHEMBL9112543 | 0.71 | L3MBTL1 (0.38) | ALDH1A1SMN1; SMN2IDO1TSHRLMNA | |
| SCHEMBL9112480 | 0.70 | TSHR (0.37) | TSHRCYP3A4CYP2D6CYP2C19HSD17B10 | |
| SCHEMBL4664738 | 0.70 | ATM (0.45) | ALDH1A1SMN1; SMN2TDP1CYP1A2CYP3A4 | |
| SCHEMBL10756064 | 0.68 | ATM (0.41) | ALDH1A1SMN1; SMN2TDP1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5453509-A | Functionalization of acyl pyridinium salts | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 1995-09-26 | — | — | US | disclosed |
| WO-1995010505-A1 | FUNCTIONALIZATION OF ACYL PYRIDINIUM SALTS | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 1995-04-20 | — | — | WO | disclosed |