Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.56 |
| ▸ | FBP1 | P09467 | 2/20 | 0.54 |
| ▸ | VCP | P55072 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | METAP1 | P53582 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6328580 | 0.92 | NFE2L2 (0.58) | TSHRNFE2L2FBP1VCPCYP19A1 | |
| SCHEMBL12470562 | 0.90 | ALDH1A1 (0.58) | TSHRNFE2L2FBP1VCPCYP19A1 | |
| SCHEMBL6376999 | 0.89 | CYP19A1 (0.61) | TSHRNFE2L2FBP1VCPCYP19A1 | |
| SCHEMBL287236 | 0.82 | TSHR (0.65) | TSHRNFE2L2LMNAMEN1KMT2A | |
| SCHEMBL3718150 | 0.81 | TSHR (0.62) | TSHRNFE2L2LMNAMEN1KMT2A | |
| SCHEMBL7137045 | 0.81 | NFE2L2 (0.61) | TSHRNFE2L2FBP1VCPCYP19A1 | |
| SCHEMBL2406215 | 0.80 | NFE2L2 (0.51) | TSHRNFE2L2FBP1VCPCYP19A1 | |
| SCHEMBL28879992 | 0.79 | TSHR (0.61) | TSHRNFE2L2LMNAMEN1KMT2A | |
| SCHEMBL7077091 | 0.79 | TSHR (0.61) | TSHRNFE2L2LMNAMEN1KMT2A | |
| SCHEMBL10678503 | 0.79 | NFE2L2 (0.59) | TSHRNFE2L2FBP1VCPCYP19A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5811422-A | USEFUL FOR TREATING VIRAL INFECTIONS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-09-22 | — | — | US | disclosed |
| US-5610294-A | VIRAL TREATMENT | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-03-11 | — | — | US | disclosed |
| US-5506355-A | REACTING DIAMINE HAVING DIOL PROTECTED WITH CYCLIC ACETAL GROUP IN SOLVENT WITH HINDERED AMINE BASE AND SULFONYL GROUP PRECURSOR, ALKYLATING IN PRESENCE OF BASE | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-04-09 | — | — | US | disclosed |