Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK7 | P49862 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | MMP1 | P03956 | 3/20 | 0.49 |
| ▸ | FCER2 | P06734 | 2/20 | 0.49 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.49 |
| ▸ | METAP2 | P50579 | 2/20 | 0.47 |
| ▸ | METAP1 | P53582 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | F2RL1 | P55085 | 2/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | PROC | P04070 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CTSD | P07339 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28555151 | 0.82 | CTSL (0.47) | RAB9AMMP1KLKB1METAP2METAP1 | |
| SCHEMBL12505311 | 0.80 | CYP2D6 (0.49) | HPGDMEN1KMT2ACYP2D6 | |
| SCHEMBL29214291 | 0.79 | METAP2 (0.46) | KLK7NPC1RAB9AMMP1FCER2 | |
| SCHEMBL29214293 | 0.79 | METAP2 (0.46) | KLK7NPC1RAB9AMMP1FCER2 | |
| SCHEMBL5520650 | 0.78 | RAB9A (0.61) | KLK7NPC1RAB9AMMP1FCER2 | |
| SCHEMBL31404859 | 0.76 | KMT2A (0.47) | RAB9AHPGDALDH1A1LMNAMEN1 | |
| SCHEMBL14696850 | 0.76 | CA12 (0.59) | HPGDALDH1A1MEN1KMT2ACYP2D6 | |
| SCHEMBL3902634 | 0.75 | CTSS (0.49) | — | |
| SCHEMBL29052587 | 0.74 | ALDH1A1 (0.42) | METAP2METAP1ALDH1A1CPB2KMT2A | |
| SCHEMBL29052588 | 0.74 | ALDH1A1 (0.42) | METAP2METAP1ALDH1A1CPB2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110627867-A | Peptide-like small molecule compound acting on MLL fusion protein | 中国药科大学 | 2019-12-31 | — | — | CN | disclosed |