Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.46 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.46 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8729220 | 0.94 | TSHR (0.55) | TSHRHDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL6824408 | 0.86 | TSHR (0.55) | TSHRSMN1; SMN2POLBHTR2ACETP | |
| SCHEMBL217735 | 0.79 | MAOA (0.50) | TSHRHDAC1SMN1; SMN2MAOAMAOB | |
| SCHEMBL4406117 | 0.78 | S1PR2 (0.69) | TSHRHDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL7434180 | 0.78 | TSHR (0.61) | TSHRHDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL7265672 | 0.77 | TSHR (0.55) | TSHRSMN1; SMN2POLBHTR2ACETP | |
| SCHEMBL28529985 | 0.77 | TSHR (0.50) | TSHRHDAC3MAPK1ADRA1AHDAC4 | |
| Zinc Ion SCHEMBL28535948 | 0.77 | TSHR (0.50) | TSHRHDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL8641479 | 0.75 | TSHR (0.58) | TSHRHDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL11775231 | 0.74 | TSHR (0.62) | TSHRMAPK1S1PR2S1PR4S1PR1 |
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-4900860-A | Process for preparing phosphonyloxyacyl amino acids | E. R. SQUIBB & SONS, INC. (US) | 1990-02-13 | — | — | US | disclosed |
| US-4885380-A | REACTING PHOSPHONIC ACID DICHLORIDE WITH ALPHA-HYDROXY ACID TO FORM CYCLIC MIXED ANHYDRIDE; REACTING WITH AMINO ACID | THOTTATHIL JOHN K (US) | 1989-12-05 | — | — | US | disclosed |
| EP-0237264-A2 | Process for preparing phosphonyloxyacyl amino acids and derivates thereof | E.R. Squibb & Sons, Inc. (US) | 1987-09-16 | — | — | EP | disclosed |