Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CETP | P11597 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | UBE2N | P61088 | 1/20 | 0.40 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.39 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.39 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11222818 | 0.88 | ALDH1A1 (0.40) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| SCHEMBL11511106 | 0.85 | CYP2D6 (0.40) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| SCHEMBL11509395 | 0.82 | KDM4E (0.39) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| SCHEMBL7173229 | 0.82 | OPRM1 (0.44) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| SCHEMBL6555668 | 0.82 | OPRM1 (0.44) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| SCHEMBL7604981 | 0.82 | OPRM1 (0.44) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| SCHEMBL6557571 | 0.79 | OPRM1 (0.46) | CYP2D6SPHK1KDM4ETP53OPRM1 | |
| Bromide SCHEMBL7946644 | 0.78 | ALDH1A1 (0.39) | KDM4EOPRM1LMNAGNAI3GNAO1 | |
| Bromide SCHEMBL7946633 | 0.78 | ALDH1A1 (0.39) | KDM4EOPRM1LMNAGNAI3GNAO1 | |
| SCHEMBL12715979 | 0.78 | ALDH1A1 (0.41) | SPHK1KDM4ETP53OPRM1LMNA |
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-4159996-A | Preparation of alkane diamines | TEXACO INC. (US) | 1979-07-03 | — | — | US | disclosed |