Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 8/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.36 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.36 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Butylamine SCHEMBL28213944 | 0.97 | DNM1 (0.53) | DNM1ALDH1A1MEN1KMT2ATSHR | |
| Butylamine SCHEMBL3465015 | 0.94 | — | — | |
| Butylamine SCHEMBL28214609 | 0.91 | DNM1 (0.53) | DNM1ALDH1A1MEN1KMT2ATSHR | |
| Isopropylamine SCHEMBL9697718 | 0.87 | ALDH1A1 (0.44) | DNM1ALDH1A1MEN1KMT2ATSHR | |
| Butylamine SCHEMBL15993516 | 0.86 | OPRM1 (0.48) | DNM1ALDH1A1MEN1KMT2ATSHR | |
| Isopropylamine SCHEMBL11609315 | 0.85 | DNM1 (0.71) | DNM1ALDH1A1MEN1KMT2ATSHR | |
| Butylamine SCHEMBL5832754 | 0.84 | — | — | |
| Butylamine SCHEMBL6374277 | 0.84 | — | — | |
| Isopropylamine SCHEMBL4217378 | 0.84 | — | — | |
| Butylamine SCHEMBL624107 | 0.83 | OPRM1 (0.41) | DNM1ALDH1A1MEN1KMT2ATSHR |
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-4115564-A | Treatment of diarrhea with amidinoureas | WILLIAM H. RORER, INC. (US) | 1978-09-19 | — | — | US | disclosed |