Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.51 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7973254 | 0.88 | PLK1 (0.56) | PLK1ALDH1A1TDP1TAS1R3TAS1R1 | |
| SCHEMBL7973340 | 0.85 | PLK1 (0.61) | PLK1ALDH1A1TDP1TAS1R3TAS1R1 | |
| SCHEMBL7990728 | 0.83 | HDAC1 (0.59) | ALDH1A1TDP1GAALMNANPC1 | |
| SCHEMBL24052290 | 0.83 | HDAC8 (0.59) | PLK1LMNAHPGDSMN1; SMN2HDAC8 | |
| SCHEMBL25751728 | 0.83 | THRA (0.49) | PLK1LMNAHPGDSMN1; SMN2PTPN1 | |
| SCHEMBL27061717 | 0.82 | SCN9A (0.42) | PLK1ALDH1A1TDP1LMNAHPGD | |
| SCHEMBL7987132 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TDP1GAALMNAHPGD | |
| SCHEMBL24052028 | 0.81 | PARP10 (0.46) | ALDH1A1LMNANPC1HPGDSMN1; SMN2 | |
| SCHEMBL24420690 | 0.81 | LMNA (0.51) | ALDH1A1TDP1GAALMNANPC1 | |
| SCHEMBL7984827 | 0.81 | FLT1 (0.61) | ALDH1A1GAALMNANPC1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |