Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | RAF1 | P04049 | 1/20 | 0.47 |
| ▸ | BRAF | P15056 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.45 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL10874779 | 0.87 | NPC1 (0.68) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL11091761 | 0.86 | CYP1A2 (0.55) | CYP1A2CYP2C19SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL11091481 | 0.82 | L3MBTL1 (0.54) | SMN1; SMN2ALDH1A1KDM4EGAAL3MBTL1 | |
| SCHEMBL11094302 | 0.81 | ALDH1A1 (0.59) | CYP1A2SMN1; SMN2ALDH1A1KDM4EGAA | |
| SCHEMBL10192674 | 0.81 | NPC1 (0.64) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL5056843 | 0.80 | CYP2C19 (0.60) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL27567788 | 0.79 | CYP1A2 (0.63) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL4650207 | 0.79 | NPC1 (0.58) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL1490611 | 0.79 | NPC1 (0.57) | NPC1RAB9ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL10192673 | 0.78 | NPC1 (0.56) | NPC1RAB9ACYP1A2CYP2C19SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4469874-A | ALKYL THIOSALICYLATES | MONSANTO COMPANY (US) | 1984-09-04 | — | — | US | disclosed |
| US-4283508-A | Fragrant prevulcanization inhibitors | MONSANTO COMPANY (US) | 1981-08-11 | — | — | US | disclosed |