Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 5/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6965003 | 0.91 | PHGDH (0.51) | PHGDHCYP3A4CYP2C19NPC1MEN1 | |
| SCHEMBL6956121 | 0.89 | KMT2A (0.45) | PHGDHCYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL6962349 | 0.87 | PHGDH (0.54) | PHGDHCYP3A4CYP2C19NPC1MEN1 | |
| SCHEMBL6953108 | 0.87 | GAA (0.51) | PHGDHCYP3A4CYP2C19NPC1MEN1 | |
| SCHEMBL6654161 | 0.86 | PHGDH (0.60) | PHGDHCYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL6653052 | 0.83 | PHGDH (0.56) | PHGDHCYP3A4CYP2C19NPC1MEN1 | |
| SCHEMBL6650847 | 0.82 | MAPT (0.54) | PHGDHCYP3A4CYP2C19NPC1MEN1 | |
| SCHEMBL6961290 | 0.81 | KMT2A (0.46) | PHGDHCYP3A4CYP2C19KMT2ALMNA | |
| SCHEMBL6956612 | 0.80 | PHGDH (0.40) | PHGDHCYP3A4MEN1KMT2APOLB | |
| SCHEMBL6652041 | 0.78 | CYP3A4 (0.49) | PHGDHCYP3A4CYP2C19NPC1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0850222-B1 | PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF | SAMJIN PHARM CO LTD (KR) | 2003-05-28 | — | — | EP | disclosed |
| US-6028195-A | AN ANTITUMOR AGENT WITH VERY LOW TOXICITIES | SAMJIN PHARMACEUTICAL CO., LTD. (KR) | 2000-02-22 | — | — | US | disclosed |