Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CBFB | Q13951 | 2/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | STAT3 | P40763 | 1/20 | 0.30 |
| ▸ | STAT1 | P42224 | 1/20 | 0.30 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11252508 | 0.80 | NPBWR1 (0.35) | HTTHSD17B10S1PR4 | |
| SCHEMBL11251809 | 0.75 | PTGES (0.34) | HTTS1PR4 | |
| SCHEMBL11245732 | 0.75 | GUSB (0.45) | ALDH1A1S1PR4KDM4EMEN1KMT2A | |
| SCHEMBL11251103 | 0.74 | ALDH1A1 (0.41) | HTTHSD17B10ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL11248749 | 0.72 | PSD (0.32) | HTTHSD17B10S1PR4 | |
| SCHEMBL11250828 | 0.70 | GAA (0.48) | HTTHSD17B10ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL11256429 | 0.69 | NPBWR1 (0.45) | S1PR4PDK2 | |
| SCHEMBL11245386 | 0.69 | AMY1A (0.33) | — | |
| SCHEMBL11245574 | 0.69 | NT5E (0.41) | — | |
| SCHEMBL11261743 | 0.68 | PTGES (0.36) | — |
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-4314844-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1982-02-09 | — | — | US | disclosed |