Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.57 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.51 |
| ▸ | KMO | O15229 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RORC | P51449 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11705201 | 0.94 | HAO1 (0.61) | HAO1BCL2L1MCL1KMOEPHX2 | |
| SCHEMBL3706067 | 0.89 | MAPT (0.56) | HAO1BCL2L1MCL1SIGMAR1PLAU | |
| SCHEMBL16178628 | 0.89 | HAO1 (0.53) | HAO1BCL2L1MCL1KMOSIGMAR1 | |
| SCHEMBL6276699 | 0.82 | HAO1 (0.55) | HAO1BCL2L1MCL1MAPTALDH1A1 | |
| SCHEMBL11674678 | 0.82 | HAO1 (0.53) | HAO1BCL2L1MCL1KMOEPHX2 | |
| SCHEMBL2649112 | 0.82 | HAO1 (0.53) | HAO1BCL2L1MCL1KMOEPHX2 | |
| SCHEMBL7199268 | 0.79 | MAPT (0.67) | PLAUMAPTL3MBTL1S1PR5ALDH1A1 | |
| SCHEMBL11218828 | 0.78 | KMO (0.57) | HAO1KMOMAPTL3MBTL1ALDH1A1 | |
| SCHEMBL16178630 | 0.78 | NPC1 (0.54) | EPHX2MAPTL3MBTL1SRD5A2 | |
| SCHEMBL4049737 | 0.78 | KMT2A (0.61) | HAO1KMOMAPTALDH1A1SMN1; SMN2 |
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-4016214-A | Preparation of ethynylbenzenes | WILLIAM H. RORER, INC. (US) | 1977-04-05 | — | — | US | disclosed |
| US-3952067-A | Ethynylbenzenes | WILLIAM H. RORER, INC. (US) | 1976-04-20 | — | — | US | disclosed |