Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11252915 | 0.84 | ALDH1A1 (0.38) | NPSR1ATMTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL10351366 | 0.81 | SMN1; SMN2 (0.36) | NPSR1ATMTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL11249078 | 0.81 | ALDH1A1 (0.41) | NPSR1ALDH1A1KDM4ENPC1KMT2A | |
| SCHEMBL28026368 | 0.80 | NPSR1 (0.48) | NPSR1ATMTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL195179 | 0.80 | NPSR1 (0.54) | NPSR1ATMTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL11250213 | 0.78 | ALDH1A1 (0.39) | TDP1ALDH1A1KDM4ENPC1POLB | |
| SCHEMBL11253758 | 0.78 | KMT2A (0.34) | NPSR1ALDH1A1KDM4ENPC1KMT2A | |
| SCHEMBL11244321 | 0.78 | ALDH1A1 (0.39) | NPSR1TDP1L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL2935480 | 0.78 | NPSR1 (0.50) | NPSR1ATMTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL11241076 | 0.77 | SMN1; SMN2 (0.36) | NPSR1ATML3MBTL1ALDH1A1NPC1 |
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-4311648-A | VULCANIZATION INHIBITION | MONSANTO COMPANY (US) | 1982-01-19 | — | — | US | disclosed |
| US-4291141-A | INHIBITORS OF PREMATURE VULCANIZATION OF DIENES | MONSANTO COMPANY (US) | 1981-09-22 | — | — | US | disclosed |