Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.49 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | PADI4 | Q9UM07 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13753394 | 0.76 | RAB9A (0.55) | RAB9ANPC1KMT2APKMSMN1; SMN2 | |
| SCHEMBL1877283 | 0.76 | RAB9A (0.57) | RAB9ANPC1KMT2APKMSMN1; SMN2 | |
| SCHEMBL2363959 | 0.74 | PHGDH (0.57) | RAB9ANPC1KMT2AHDAC1HDAC2 | |
| SCHEMBL2363887 | 0.73 | NPC1 (0.56) | RAB9ANPC1KMT2AHDAC6HDAC3 | |
| SCHEMBL13585502 | 0.73 | NPC1 (0.56) | RAB9ANPC1KMT2AHDAC6HDAC3 | |
| SCHEMBL13753484 | 0.73 | RAB9A (0.49) | RAB9ANPC1KMT2APKMSMN1; SMN2 | |
| SCHEMBL28450516 | 0.73 | RAB9A (0.63) | RAB9ANPC1KMT2APKMSMN1; SMN2 | |
| SCHEMBL2234114 | 0.73 | SLC1A2 (0.54) | RAB9ANPC1HDAC6HPGDHDAC3 | |
| SCHEMBL2363843 | 0.72 | SMYD3 (0.49) | RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL28450058 | 0.72 | CA2 (0.50) | RAB9ANPC1KMT2APADI4 |
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-2531520-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CXCR7 MODULATING ACTIVITY | Polyphor AG (CH) | 2012-12-12 | — | — | EP | disclosed |
| WO-2011095607-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CXCR7 MODULATING ACTIVITY | POLYPHOR AG (CH) | 2011-08-11 | — | — | WO | disclosed |