Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | 0.80 | ALDH1A1 (0.38) | TSHRALDH1A1KDM4ENPSR1HPGD | |
| SCHEMBL11245673 | 0.78 | NPSR1 (0.42) | KMT2AMEN1TSHRALDH1A1KDM4E | |
| SCHEMBL11249078 | 0.78 | ALDH1A1 (0.41) | KMT2AMEN1TSHRALDH1A1KDM4E | |
| SCHEMBL10351366 | 0.74 | SMN1; SMN2 (0.36) | TSHRALDH1A1KDM4ENPSR1HPGD | |
| SCHEMBL11298575 | 0.73 | MEN1 (0.37) | KMT2AMEN1TSHRALDH1A1NPSR1 | |
| SCHEMBL11250213 | 0.72 | ALDH1A1 (0.39) | TSHRALDH1A1KDM4EHPGDGLA | |
| SCHEMBL11244321 | 0.72 | ALDH1A1 (0.39) | KMT2AMEN1TSHRALDH1A1KDM4E | |
| SCHEMBL11241076 | 0.71 | SMN1; SMN2 (0.36) | KMT2AMEN1TSHRALDH1A1NPSR1 | |
| SCHEMBL195179 | 0.70 | NPSR1 (0.54) | KMT2AMEN1TSHRALDH1A1KDM4E | |
| SCHEMBL11253803 | 0.70 | PKM (0.38) | KMT2AMEN1TSHRALDH1A1KDM4E |
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 |