Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | BCL2 | P10415 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.40 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.40 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.40 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15313692 | 0.88 | NPC1 (0.48) | HDAC8BCL2TDP1MCL1POLB | |
| SCHEMBL15313682 | 0.84 | RAB9A (0.51) | HDAC8BCL2MCL1POLBLMNA | |
| SCHEMBL15313690 | 0.76 | BCL2 (0.43) | HDAC8BCL2MCL1MAPTPTGER1 | |
| SCHEMBL5698161 | 0.74 | BCL2 (0.58) | AKR1C3BCL2TDP1MCL1MAPT | |
| SCHEMBL9448569 | 0.71 | BCL2 (0.55) | AKR1C3BCL2TDP1MCL1MAPT | |
| SCHEMBL15313693 | 0.71 | BCL2 (0.68) | BCL2MCL1POLB | |
| SCHEMBL30516311 | 0.70 | MAPT (0.54) | AKR1C3PTGESPOLBMAPTLMNA | |
| SCHEMBL8430837 | 0.70 | BCL2 (0.59) | HSP90AA1BCL2MCL1HDAC1 | |
| SCHEMBL25526995 | 0.69 | AKR1C3 (0.59) | HSP90AA1HDAC3AKR1C3PTGESPOLB | |
| SCHEMBL28417176 | 0.69 | PTGER1 (0.49) | AKR1C3HDAC8TDP1MAPTHDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8557812-B2 | Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2013-10-15 | — | — | US | disclosed |
| US-8557812-B2 | Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2013-10-15 | — | — | US | disclosed |