Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TOP2A | P11388 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8851232 | 1.00 | RAB9A (0.50) | RAB9ANPC1MEN1KMT2AATM | |
| SCHEMBL8851333 | 1.00 | RAB9A (0.50) | RAB9ANPC1MEN1KMT2AATM | |
| SCHEMBL9579178 | 0.92 | RAB9A (0.54) | RAB9ANPC1MEN1KMT2AATM | |
| Styrene SCHEMBL27489496 | 0.92 | ALDH1A1 (0.45) | RAB9ANPC1MEN1KMT2AATM | |
| Acrylonitrile SCHEMBL28869634 | 0.90 | RAB9A (0.42) | RAB9ANPC1MEN1KMT2AATM | |
| Methyl Alcohol SCHEMBL28009509 | 0.90 | RAB9A (0.61) | RAB9ANPC1MEN1KMT2AATM | |
| SCHEMBL27624568 | 0.87 | NPC1 (0.48) | RAB9ANPC1MEN1KMT2AATM | |
| SCHEMBL9359592 | 0.85 | MEN1 (0.67) | RAB9ANPC1MEN1KMT2AATM | |
| SCHEMBL29371456 | 0.85 | — | — | |
| SCHEMBL15193 | 0.85 | — | — |
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-5550005-A | BLOCK POLYMER | W. R. GRACE & CO.-CONN. (US) | 1996-08-27 | — | — | US | disclosed |
| US-5290662-A | Quaternized triblock copolymers on backings | W. R. GRACE & CO.-CONN. (US) | 1994-03-01 | — | — | US | disclosed |
| US-5223375-A | Butadiene-vinyl pyridine or isoprene-vinyl pyridene block polymer | W. R. GRACE & CO.-CONN. (US) | 1993-06-29 | — | — | US | disclosed |