Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.86 |
| ▸ | TSHR | P16473 | 3/20 | 0.86 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.86 |
| ▸ | MAPT | P10636 | 4/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.72 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.72 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.72 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.72 |
| ▸ | GBA1 | P04062 | 8/20 | 0.55 |
| ▸ | NMT1 | P30419 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15289676 | 0.85 | POLB (0.98) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL4867366 | 0.80 | GBA1 (0.79) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL4863775 | 0.79 | GBA1 (0.80) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL19286344 | 0.78 | POLB (0.64) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL1084727 | 0.76 | POLB (0.61) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL13732933 | 0.74 | GBA1 (0.65) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL1083852 | 0.73 | TSHR (0.76) | SMN1; SMN2TSHRMAPK1MAPTALDH1A1 | |
| SCHEMBL16404334 | 0.72 | CYP2D6 (0.87) | SMN1; SMN2TSHRMAPK1MAPTALDH1A1 | |
| SCHEMBL1084528 | 0.71 | POLB (0.55) | POLBSMN1; SMN2TSHRMAPK1MAPT | |
| SCHEMBL18353895 | 0.71 | GBA1 (1.00) | POLBSMN1; SMN2TSHRMAPK1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9744171-B2 | Positive allosteric modulators for melanocortin receptors | VANDERBILT UNIVERSITY (US) | 2017-08-29 | — | — | US | disclosed |
| US-8343980-B2 | Quinazoles useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-01-01 | — | — | US | disclosed |
| US-8153642-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-04-10 | — | — | US | disclosed |
| US-7713983-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-05-11 | — | — | US | disclosed |
| US-7713983-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-05-11 | — | — | US | disclosed |
| US-7678802-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-16 | — | — | US | disclosed |
| US-7678802-B2 | Quinazolines useful as modulators of ion channels | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-16 | — | — | US | disclosed |